ChemLookup: August 2011

Wednesday, August 31, 2011

http://ChemLookup.com Compounds

CAS RN: 10580-02-6
CAS Name: ammonium; oxalate; titanium
OPENEYE Name: ammonium; oxalate; titanium
IUPAC Name: azanium; oxalate; titanium
SYSTEMATIC NAME: azanium; ethanedioate; titanium
MOLECULAR FORMULA: C2H4NO4Ti-
MOLECULAR WEIGHT: 153.92446
SMILES: C(=O)(C(=O)[O-])[O-].[NH4+].[Ti]
Structure:

CAS RN: 29213-61-4
CAS Name: ammonium; oxalate; titanium
OPENEYE Name: ammonium; oxalate; titanium
IUPAC Name: azanium; oxalate; titanium
SYSTEMATIC NAME: azanium; ethanedioate; titanium
MOLECULAR FORMULA: C2H4NO4Ti-
MOLECULAR WEIGHT: 153.92446
SMILES: C(=O)(C(=O)[O-])[O-].[NH4+].[Ti]
Structure:

CAS RN: 32685-44-2
CAS Name: ammonium; oxalate; titanium
OPENEYE Name: ammonium; oxalate; titanium
IUPAC Name: azanium; oxalate; titanium
SYSTEMATIC NAME: azanium; ethanedioate; titanium
MOLECULAR FORMULA: C2H4NO4Ti-
MOLECULAR WEIGHT: 153.92446
SMILES: C(=O)(C(=O)[O-])[O-].[NH4+].[Ti]
Structure:

CAS RN: 7745-88-2
CAS Name: (3-chloro-4-methylphenyl)ammonium; hydrogen sulfate
OPENEYE Name: (3-chloro-4-methyl-phenyl)ammonium; hydrogen sulfate
IUPAC Name: (3-chloro-4-methylphenyl)azanium; hydrogen sulfate
SYSTEMATIC NAME: (3-chloranyl-4-methyl-phenyl)azanium; hydrogen sulfate
MOLECULAR FORMULA: C7H10ClNO4S
MOLECULAR WEIGHT: 239.6766
SMILES: CC1=C(C=C(C=C1)[NH3+])Cl.OS(=O)(=O)[O-]
Structure:

CAS RN: 7666-00-4
CAS Name: 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-amine
OPENEYE Name: 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-amine
IUPAC Name: 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-amine
SYSTEMATIC NAME: 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-amine
MOLECULAR FORMULA: C29H51NO
MOLECULAR WEIGHT: 429.72134
SMILES: CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)C)N
Structure:

CAS RN: 7591-11-9
CAS Name: 2,5,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-amine
OPENEYE Name: 2,5,8-trimethyl-2-(4,8,12-trimethyltridecyl)chroman-6-amine
IUPAC Name: 2,5,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-amine
SYSTEMATIC NAME: 2,5,8-trimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-amine
MOLECULAR FORMULA: C28H49NO
MOLECULAR WEIGHT: 415.69476
SMILES: CC1=CC(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)N
Structure:

CAS RN: 7118-54-9
CAS Name: N'-(4-chlorophenyl)-4-methylbenzenecarboximidamide
OPENEYE Name: N'-(4-chlorophenyl)-4-methyl-benzamidine
IUPAC Name: N'-(4-chlorophenyl)-4-methylbenzenecarboximidamide
SYSTEMATIC NAME: N'-(4-chlorophenyl)-4-methyl-benzenecarboximidamide
MOLECULAR FORMULA: C14H13ClN2
MOLECULAR WEIGHT: 244.71942
SMILES: CC1=CC=C(C=C1)C(=NC2=CC=C(C=C2)Cl)N
Structure:

CAS RN: 6613-03-2
CAS Name: 1-prop-2-ynylpyridin-1-ium bromide
OPENEYE Name: 1-prop-2-ynylpyridin-1-ium bromide
IUPAC Name: 1-prop-2-ynylpyridin-1-ium bromide
SYSTEMATIC NAME: 1-prop-2-ynylpyridin-1-ium bromide
MOLECULAR FORMULA: C8H8BrN
MOLECULAR WEIGHT: 198.05982
SMILES: C#CC[N+]1=CC=CC=C1.[Br-]
Structure:

CAS RN: 129-06-6
CAS Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-olate
OPENEYE Name: sodium 2-oxo-3-(3-oxo-1-phenyl-butyl)chromen-4-olate
IUPAC Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)chromen-4-olate
SYSTEMATIC NAME: sodium 2-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-olate
MOLECULAR FORMULA: C19H15NaO4
MOLECULAR WEIGHT: 330.30977
SMILES: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]
Structure:

CAS RN: 12795-55-0
CAS Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-olate
OPENEYE Name: sodium 2-oxo-3-(3-oxo-1-phenyl-butyl)chromen-4-olate
IUPAC Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)chromen-4-olate
SYSTEMATIC NAME: sodium 2-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-olate
MOLECULAR FORMULA: C19H15NaO4
MOLECULAR WEIGHT: 330.30977
SMILES: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]
Structure:

CAS RN: 36508-91-5
CAS Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-olate
OPENEYE Name: sodium 2-oxo-3-(3-oxo-1-phenyl-butyl)chromen-4-olate
IUPAC Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)chromen-4-olate
SYSTEMATIC NAME: sodium 2-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-olate
MOLECULAR FORMULA: C19H15NaO4
MOLECULAR WEIGHT: 330.30977
SMILES: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]
Structure:

CAS RN: 51821-81-9
CAS Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-olate
OPENEYE Name: sodium 2-oxo-3-(3-oxo-1-phenyl-butyl)chromen-4-olate
IUPAC Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)chromen-4-olate
SYSTEMATIC NAME: sodium 2-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-olate
MOLECULAR FORMULA: C19H15NaO4
MOLECULAR WEIGHT: 330.30977
SMILES: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]
Structure:

CAS RN: 5543-79-3
CAS Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-olate
OPENEYE Name: sodium 2-oxo-3-(3-oxo-1-phenyl-butyl)chromen-4-olate
IUPAC Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)chromen-4-olate
SYSTEMATIC NAME: sodium 2-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-olate
MOLECULAR FORMULA: C19H15NaO4
MOLECULAR WEIGHT: 330.30977
SMILES: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]
Structure:

CAS RN: 859043-62-2
CAS Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-olate
OPENEYE Name: sodium 2-oxo-3-(3-oxo-1-phenyl-butyl)chromen-4-olate
IUPAC Name: sodium 2-oxo-3-(3-oxo-1-phenylbutyl)chromen-4-olate
SYSTEMATIC NAME: sodium 2-oxidanylidene-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-olate
MOLECULAR FORMULA: C19H15NaO4
MOLECULAR WEIGHT: 330.30977
SMILES: CC(=O)CC(C1=CC=CC=C1)C2=C(C3=CC=CC=C3OC2=O)[O-].[Na+]
Structure:

CAS RN: 5023-02-9
CAS Name: 2-(1-cyclohexa-1,5-dienyl)-2H-1-benzopyran-3,4-diol
OPENEYE Name: 2-cyclohexa-1,5-dien-1-yl-2H-chromene-3,4-diol
IUPAC Name: 2-cyclohexa-1,5-dien-1-yl-2H-chromene-3,4-diol
SYSTEMATIC NAME: 2-cyclohexa-1,5-dien-1-yl-2H-chromene-3,4-diol
MOLECULAR FORMULA: C15H14O3
MOLECULAR WEIGHT: 242.26986
SMILES: C1CC=C(C=C1)C2C(=C(C3=CC=CC=C3O2)O)O
Structure:

CAS RN: 4086-05-9
CAS Name: disodium [4-chloro-2-(5-chloro-7-methoxy-4-methyl-3-sulfonatooxy-1H-indol-2-yl)-1-naphthalenyl] sulfate
OPENEYE Name: disodium [4-chloro-2-(5-chloro-7-methoxy-4-methyl-3-sulfonatooxy-1H-indol-2-yl)-1-naphthyl] sulfate
IUPAC Name: disodium [4-chloro-2-(5-chloro-7-methoxy-4-methyl-3-sulfonatooxy-1H-indol-2-yl)naphthalen-1-yl] sulfate
SYSTEMATIC NAME: disodium [4-chloranyl-2-(5-chloranyl-7-methoxy-4-methyl-3-sulfonatooxy-1H-indol-2-yl)naphthalen-1-yl] sulfate
MOLECULAR FORMULA: C20H13Cl2NNa2O9S2
MOLECULAR WEIGHT: 592.33406
SMILES: CC1=C(C=C(C2=C1C(=C(N2)C3=C(C4=CC=CC=C4C(=C3)Cl)OS(=O)(=O)[O-])OS(=O)(=O)[O-])OC)Cl.[Na+].[Na+]
Structure:

CAS RN: 3625-81-8
CAS Name: diaminomethylidene(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)ammonium sulfate
OPENEYE Name: diaminomethylene(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)ammonium sulfate
IUPAC Name: diaminomethylidene(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azanium sulfate
SYSTEMATIC NAME: bis(azanyl)methylidene-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azanium sulfate
MOLECULAR FORMULA: C10H14N3O6S-
MOLECULAR WEIGHT: 304.29966
SMILES: C1C(OC2=CC=CC=C2O1)C[NH+]=C(N)N.[O-]S(=O)(=O)[O-]
Structure:

CAS RN: 3262-86-0
CAS Name: dodecanoic acid [4,5-bis(acetyloxymethyl)-2-methyl-3-pyridinyl] ester hydrochloride
OPENEYE Name: [4,5-bis(acetoxymethyl)-2-methyl-3-pyridyl] dodecanoate hydrochloride
IUPAC Name: [4,5-bis(acetyloxymethyl)-2-methylpyridin-3-yl] dodecanoate hydrochloride
SYSTEMATIC NAME: [4,5-bis(acetyloxymethyl)-2-methyl-pyridin-3-yl] dodecanoate hydrochloride
MOLECULAR FORMULA: C24H38ClNO6
MOLECULAR WEIGHT: 472.01462
SMILES: CCCCCCCCCCCC(=O)OC1=C(C(=CN=C1C)COC(=O)C)COC(=O)C.Cl
Structure:

CAS RN: 2589-58-4
CAS Name: N-butan-2-yl-2,1-benzothiazol-3-amine
OPENEYE Name: N-sec-butyl-2,1-benzothiazol-3-amine
IUPAC Name: N-butan-2-yl-2,1-benzothiazol-3-amine
SYSTEMATIC NAME: N-butan-2-yl-2,1-benzothiazol-3-amine
MOLECULAR FORMULA: C11H14N2S
MOLECULAR WEIGHT: 206.30726
SMILES: CCC(C)NC1=C2C=CC=CC2=NS1
Structure:

CAS RN: 1059-95-6
CAS Name: N'-[oxo(4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methyl]-N'-(phenylmethyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbohydrazide
OPENEYE Name: N'-benzyl-N'-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbohydrazide
IUPAC Name: N'-benzyl-N'-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbohydrazide
SYSTEMATIC NAME: N'-(phenylmethyl)-N'-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylcarbonyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbohydrazide
MOLECULAR FORMULA: C23H24N4O4
MOLECULAR WEIGHT: 420.46106
SMILES: C1CCC2=C(C1)C(=NO2)C(=O)NN(CC3=CC=CC=C3)C(=O)C4=NOC5=C4CCCC5
Structure:

CAS RN: 877-13-4
CAS Name: 3,4,6-trichloro-5-hydroxycyclohexa-3,5-diene-1,2-dione
OPENEYE Name: 3,4,6-trichloro-5-hydroxy-1,2-benzoquinone
IUPAC Name: 3,4,6-trichloro-5-hydroxycyclohexa-3,5-diene-1,2-dione
SYSTEMATIC NAME: 3,4,6-tris(chloranyl)-5-oxidanyl-cyclohexa-3,5-diene-1,2-dione
MOLECULAR FORMULA: C6HCl3O3
MOLECULAR WEIGHT: 227.42934
SMILES: C1(=C(C(=O)C(=O)C(=C1Cl)Cl)Cl)O
Structure:

CAS RN: 774-15-2
CAS Name: N-propan-2-yl-2,1-benzothiazol-3-amine
OPENEYE Name: N-isopropyl-2,1-benzothiazol-3-amine
IUPAC Name: N-propan-2-yl-2,1-benzothiazol-3-amine
SYSTEMATIC NAME: N-propan-2-yl-2,1-benzothiazol-3-amine
MOLECULAR FORMULA: C10H12N2S
MOLECULAR WEIGHT: 192.28068
SMILES: CC(C)NC1=C2C=CC=CC2=NS1
Structure:

CAS RN: 743-98-6
CAS Name: 1-ethenyl-4-[[ethoxy(phenyl)phosphoryl]methyl]naphthalene
OPENEYE Name: 1-[[ethoxy(phenyl)phosphoryl]methyl]-4-vinyl-naphthalene
IUPAC Name: 1-ethenyl-4-[[ethoxy(phenyl)phosphoryl]methyl]naphthalene
SYSTEMATIC NAME: 1-ethenyl-4-[[ethoxy(phenyl)phosphoryl]methyl]naphthalene
MOLECULAR FORMULA: C21H21O2P
MOLECULAR WEIGHT: 336.364001
SMILES: CCOP(=O)(CC1=CC=C(C2=CC=CC=C12)C=C)C3=CC=CC=C3
Structure:

CAS RN: 712-12-9
CAS Name: N-(2-methylpropyl)-2,1-benzothiazol-3-amine
OPENEYE Name: N-isobutyl-2,1-benzothiazol-3-amine
IUPAC Name: N-(2-methylpropyl)-2,1-benzothiazol-3-amine
SYSTEMATIC NAME: N-(2-methylpropyl)-2,1-benzothiazol-3-amine
MOLECULAR FORMULA: C11H14N2S
MOLECULAR WEIGHT: 206.30726
SMILES: CC(C)CNC1=C2C=CC=CC2=NS1
Structure:

http://ChemLookup.com Compounds

CAS RN: 14928-91-7
CAS Name: 3-[N-(2-cyanoethyl)-4-[(E)-2-(1,3,3-trimethyl-2-indol-1-iumyl)ethenyl]anilino]propanenitrile chloride
OPENEYE Name: 3-[N-(2-cyanoethyl)-4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)vinyl]anilino]propanenitrile chloride
IUPAC Name: 3-[N-(2-cyanoethyl)-4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]anilino]propanenitrile chloride
SYSTEMATIC NAME: 3-[2-cyanoethyl-[4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]phenyl]amino]propanenitrile chloride
MOLECULAR FORMULA: C25H27ClN4
MOLECULAR WEIGHT: 418.96168
SMILES: CC1(C2=CC=CC=C2[N+](=C1/C=C/C3=CC=C(C=C3)N(CCC#N)CCC#N)C)C.[Cl-]
Structure:

CAS RN: 14472-28-7
CAS Name: aluminum 4-methylbenzenesulfonate
OPENEYE Name: aluminum 4-methylbenzenesulfonate
IUPAC Name: aluminum 4-methylbenzenesulfonate
SYSTEMATIC NAME: aluminum 4-methylbenzenesulfonate
MOLECULAR FORMULA: C7H7AlO3S+2
MOLECULAR WEIGHT: 198.175218
SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].[Al+3]
Structure:

CAS RN: 14467-75-5
CAS Name: N-propylcarbamothioic acid S-phenyl ester
OPENEYE Name: S-phenyl N-propylcarbamothioate
IUPAC Name: S-phenyl N-propylcarbamothioate
SYSTEMATIC NAME: S-phenyl N-propylcarbamothioate
MOLECULAR FORMULA: C10H13NOS
MOLECULAR WEIGHT: 195.28132
SMILES: CCCNC(=O)SC1=CC=CC=C1
Structure:

CAS RN: 13427-63-9
CAS Name: hydrogen sulfite; 2-hydroxyethylammonium
OPENEYE Name: hydrogen sulfite; 2-hydroxyethylammonium
IUPAC Name: hydrogen sulfite; 2-hydroxyethylazanium
SYSTEMATIC NAME: hydrogen sulfite; 2-hydroxyethylazanium
MOLECULAR FORMULA: C2H9NO4S
MOLECULAR WEIGHT: 143.16216
SMILES: C(CO)[NH3+].OS(=O)[O-]
Structure:

CAS RN: 12428-64-7
CAS Name: tetraaluminum decahydroxide sulfate
OPENEYE Name: tetraaluminum decahydroxide sulfate
IUPAC Name: tetraaluminum decahydroxide sulfate
SYSTEMATIC NAME: tetraaluminum decahydroxide sulfate
MOLECULAR FORMULA: Al4H10O14S
MOLECULAR WEIGHT: 374.062152
SMILES: [OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3].[Al+3].[Al+3]
Structure:

CAS RN: 12365-92-3
CAS Name: 4,7-dichloroquinolin-1-ium tribromide
OPENEYE Name: 4,7-dichloroquinolin-1-ium tribromide
IUPAC Name: 4,7-dichloroquinolin-1-ium tribromide
SYSTEMATIC NAME: 4,7-bis(chloranyl)quinolin-1-ium tribromide
MOLECULAR FORMULA: C9H6Br3Cl2N-2
MOLECULAR WEIGHT: 438.76864
SMILES: C1=CC2=C(C=C[NH+]=C2C=C1Cl)Cl.[Br-].[Br-].[Br-]
Structure:

CAS RN: 12294-20-1
CAS Name: sodium decaborate
OPENEYE Name: sodium decaborate
IUPAC Name: sodium decaborate
SYSTEMATIC NAME: sodium decaborate
MOLECULAR FORMULA: B10NaO30-29
MOLECULAR WEIGHT: 611.08177
SMILES: B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].[Na+]
Structure:

CAS RN: 12271-95-3
CAS Name: disilver tetraborate
OPENEYE Name: disilver tetraborate
IUPAC Name: disilver tetraborate
SYSTEMATIC NAME: disilver tetraborate
MOLECULAR FORMULA: Ag2B4O12-10
MOLECULAR WEIGHT: 450.9732
SMILES: B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].[Ag+].[Ag+]
Structure:

CAS RN: 12168-31-9
CAS Name: pentastrontium fluoride triphosphate
OPENEYE Name: pentastrontium fluoride triphosphate
IUPAC Name: pentastrontium fluoride triphosphate
SYSTEMATIC NAME: pentastrontium fluoride triphosphate
MOLECULAR FORMULA: FO12P3Sr5
MOLECULAR WEIGHT: 742.012486
SMILES: [O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[F-].[Sr+2].[Sr+2].[Sr+2].[Sr+2].[Sr+2]
Structure:

CAS RN: 12007-67-9
CAS Name: zinc tetraborate
OPENEYE Name: zinc tetraborate
IUPAC Name: zinc tetraborate
SYSTEMATIC NAME: zinc tetraborate
MOLECULAR FORMULA: B4O12Zn-10
MOLECULAR WEIGHT: 300.6458
SMILES: B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].B([O-])([O-])[O-].[Zn+2]
Structure:

CAS RN: 11121-16-7
CAS Name: aluminum borate
OPENEYE Name: aluminum borate
IUPAC Name: aluminum borate
SYSTEMATIC NAME: aluminum borate
MOLECULAR FORMULA: AlBO3
MOLECULAR WEIGHT: 85.790738
SMILES: B([O-])([O-])[O-].[Al+3]
Structure:

CAS RN: 12794-91-1
CAS Name: aluminum borate
OPENEYE Name: aluminum borate
IUPAC Name: aluminum borate
SYSTEMATIC NAME: aluminum borate
MOLECULAR FORMULA: AlBO3
MOLECULAR WEIGHT: 85.790738
SMILES: B([O-])([O-])[O-].[Al+3]
Structure:

CAS RN: 134914-32-2
CAS Name: aluminum borate
OPENEYE Name: aluminum borate
IUPAC Name: aluminum borate
SYSTEMATIC NAME: aluminum borate
MOLECULAR FORMULA: AlBO3
MOLECULAR WEIGHT: 85.790738
SMILES: B([O-])([O-])[O-].[Al+3]
Structure:

CAS RN: 11095-65-1
CAS Name: aluminum ammonium fluoride phosphate
OPENEYE Name: aluminum ammonium fluoride phosphate
IUPAC Name: aluminum azanium fluoride phosphate
SYSTEMATIC NAME: aluminum azanium fluoride phosphate
MOLECULAR FORMULA: AlFH4NO4P
MOLECULAR WEIGHT: 158.989762
SMILES: [NH4+].[O-]P(=O)([O-])[O-].[F-].[Al+3]
Structure:

CAS RN: 37303-21-2
CAS Name: aluminum ammonium fluoride phosphate
OPENEYE Name: aluminum ammonium fluoride phosphate
IUPAC Name: aluminum azanium fluoride phosphate
SYSTEMATIC NAME: aluminum azanium fluoride phosphate
MOLECULAR FORMULA: AlFH4NO4P
MOLECULAR WEIGHT: 158.989762
SMILES: [NH4+].[O-]P(=O)([O-])[O-].[F-].[Al+3]
Structure:

CAS RN: 11089-92-2
CAS Name: tetraaluminum trichloride nonahydroxide
OPENEYE Name: tetraaluminum trichloride nonahydroxide
IUPAC Name: tetraaluminum trichloride nonahydroxide
SYSTEMATIC NAME: tetraaluminum trichloride nonahydroxide
MOLECULAR FORMULA: Al4Cl3H9O9
MOLECULAR WEIGHT: 367.351212
SMILES: [OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Al+3].[Al+3].[Al+3].[Al+3].[Cl-].[Cl-].[Cl-]
Structure:

http://ChemLookup.com Compounds

CAS RN: 25935-14-2
CAS Name: 1-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)pyridin-1-ium iodide
OPENEYE Name: 1-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)pyridin-1-ium iodide
IUPAC Name: 1-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)pyridin-1-ium iodide
SYSTEMATIC NAME: 1-[3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecakis(fluoranyl)decyl]pyridin-1-ium iodide
MOLECULAR FORMULA: C15H9F17IN
MOLECULAR WEIGHT: 653.115984
SMILES: C1=CC=[N+](C=C1)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[I-]
Structure:

CAS RN: 25709-55-1
CAS Name: 2-(1-thiolan-1-iumyl)acetic acid ethyl ester bromide
OPENEYE Name: ethyl 2-tetrahydrothiophen-1-ium-1-ylacetate bromide
IUPAC Name: ethyl 2-(thiolan-1-ium-1-yl)acetate bromide
SYSTEMATIC NAME: ethyl 2-(thiolan-1-ium-1-yl)ethanoate bromide
MOLECULAR FORMULA: C8H15BrO2S
MOLECULAR WEIGHT: 255.1725
SMILES: CCOC(=O)C[S+]1CCCC1.[Br-]
Structure:

CAS RN: 24151-54-0
CAS Name: 4-[2-acetyloxyethyl-(phenylmethyl)amino]-2-chloro-5-(2-methoxyethoxy)benzenediazonium tetrafluoroborate
OPENEYE Name: 4-[2-acetoxyethyl(benzyl)amino]-2-chloro-5-(2-methoxyethoxy)benzenediazonium tetrafluoroborate
IUPAC Name: 4-[2-acetyloxyethyl(benzyl)amino]-2-chloro-5-(2-methoxyethoxy)benzenediazonium tetrafluoroborate
SYSTEMATIC NAME: 4-[2-acetyloxyethyl-(phenylmethyl)amino]-2-chloranyl-5-(2-methoxyethoxy)benzenediazonium tetrafluoroborate
MOLECULAR FORMULA: C20H23BClF4N3O4
MOLECULAR WEIGHT: 491.671933
SMILES: [B-](F)(F)(F)F.CC(=O)OCCN(CC1=CC=CC=C1)C2=C(C=C(C(=C2)Cl)[N+]#N)OCCOC
Structure:

CAS RN: 23519-20-2
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-6-methoxy-2H-benzotriazole-5-carboxamide dihydrochloride
OPENEYE Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-6-methoxy-2H-benzotriazole-5-carboxamide dihydrochloride
IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-6-methoxy-2H-benzotriazole-5-carboxamide dihydrochloride
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-6-methoxy-2H-benzotriazole-5-carboxamide dihydrochloride
MOLECULAR FORMULA: C15H23Cl2N5O2
MOLECULAR WEIGHT: 376.28142
SMILES: CCN1CCCC1CNC(=O)C2=CC3=NNN=C3C=C2OC.Cl.Cl
Structure:

CAS RN: 22934-70-9
CAS Name: 6,7-dimethoxy-1,3-benzodioxol-5-ol
OPENEYE Name: 6,7-dimethoxy-1,3-benzodioxol-5-ol
IUPAC Name: 6,7-dimethoxy-1,3-benzodioxol-5-ol
SYSTEMATIC NAME: 6,7-dimethoxy-1,3-benzodioxol-5-ol
MOLECULAR FORMULA: C9H10O5
MOLECULAR WEIGHT: 198.1727
SMILES: COC1=C(C=C2C(=C1OC)OCO2)O
Structure:

CAS RN: 22816-64-4
CAS Name: decyl sulfate; 5-methyl-8-quinolin-1-iumol
OPENEYE Name: decyl sulfate; 5-methylquinolin-1-ium-8-ol
IUPAC Name: decyl sulfate; 5-methylquinolin-1-ium-8-ol
SYSTEMATIC NAME: decyl sulfate; 5-methylquinolin-1-ium-8-ol
MOLECULAR FORMULA: C20H31NO5S
MOLECULAR WEIGHT: 397.52884
SMILES: CCCCCCCCCCOS(=O)(=O)[O-].CC1=C2C=CC=[NH+]C2=C(C=C1)O
Structure:

CAS RN: 22320-77-0
CAS Name: 1-(phenylmethyl)pyridin-1-ium thiocyanate
OPENEYE Name: 1-benzylpyridin-1-ium thiocyanate
IUPAC Name: 1-benzylpyridin-1-ium thiocyanate
SYSTEMATIC NAME: 1-(phenylmethyl)pyridin-1-ium thiocyanate
MOLECULAR FORMULA: C13H12N2S
MOLECULAR WEIGHT: 228.31278
SMILES: C1=CC=C(C=C1)C[N+]2=CC=CC=C2.C(#N)[S-]
Structure:

CAS RN: 21584-04-3
CAS Name: 4-[(1-ethyl-2-quinolin-1-iumyl)methylideneamino]-N,N-dimethylaniline iodide
OPENEYE Name: 4-[(1-ethylquinolin-1-ium-2-yl)methyleneamino]-N,N-dimethyl-aniline iodide
IUPAC Name: 4-[(1-ethylquinolin-1-ium-2-yl)methylideneamino]-N,N-dimethylaniline iodide
SYSTEMATIC NAME: 4-[(1-ethylquinolin-1-ium-2-yl)methylideneamino]-N,N-dimethyl-aniline iodide
MOLECULAR FORMULA: C20H22IN3
MOLECULAR WEIGHT: 431.31325
SMILES: CC[N+]1=C(C=CC2=CC=CC=C21)C=NC3=CC=C(C=C3)N(C)C.[I-]
Structure:

CAS RN: 20210-73-5
CAS Name: 4-methylbenzenesulfonic acid [4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthracenyl)oxy]phenyl] ester
OPENEYE Name: [4-[(1-amino-4-hydroxy-9,10-dioxo-2-anthryl)oxy]phenyl] 4-methylbenzenesulfonate
IUPAC Name: [4-(1-amino-4-hydroxy-9,10-dioxoanthracen-2-yl)oxyphenyl] 4-methylbenzenesulfonate
SYSTEMATIC NAME: [4-[1-azanyl-4-oxidanyl-9,10-bis(oxidanylidene)anthracen-2-yl]oxyphenyl] 4-methylbenzenesulfonate
MOLECULAR FORMULA: C27H19NO7S
MOLECULAR WEIGHT: 501.50726
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)OC3=C(C4=C(C(=C3)O)C(=O)C5=CC=CC=C5C4=O)N
Structure:

CAS RN: 19585-43-4
CAS Name: morpholin-4-ium tetrafluoroborate
OPENEYE Name: morpholin-4-ium tetrafluoroborate
IUPAC Name: morpholin-4-ium tetrafluoroborate
SYSTEMATIC NAME: morpholin-4-ium tetrafluoroborate
MOLECULAR FORMULA: C4H10BF4NO
MOLECULAR WEIGHT: 174.932913
SMILES: [B-](F)(F)(F)F.C1COCC[NH2+]1
Structure:

CAS RN: 767-23-7
CAS Name: morpholin-4-ium tetrafluoroborate
OPENEYE Name: morpholin-4-ium tetrafluoroborate
IUPAC Name: morpholin-4-ium tetrafluoroborate
SYSTEMATIC NAME: morpholin-4-ium tetrafluoroborate
MOLECULAR FORMULA: C4H10BF4NO
MOLECULAR WEIGHT: 174.932913
SMILES: [B-](F)(F)(F)F.C1COCC[NH2+]1
Structure:

CAS RN: 18941-13-4
CAS Name: 6-azido-N2,N4-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
OPENEYE Name: 6-azido-N2,N4-diisopropyl-1,3,5-triazine-2,4-diamine
IUPAC Name: 6-azido-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-azido-N2,N4-di(propan-2-yl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C9H16N8
MOLECULAR WEIGHT: 236.27694
SMILES: CC(C)NC1=NC(=NC(=N1)N=[N+]=[N-])NC(C)C
Structure:

CAS RN: 18941-09-8
CAS Name: 6-azido-N4-methyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine
OPENEYE Name: 6-azido-N2-isopropyl-N4-methyl-1,3,5-triazine-2,4-diamine
IUPAC Name: 6-azido-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-azido-N4-methyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C7H12N8
MOLECULAR WEIGHT: 208.22378
SMILES: CC(C)NC1=NC(=NC(=N1)NC)N=[N+]=[N-]
Structure:

CAS RN: 18230-02-9
CAS Name: 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-amine
OPENEYE Name: 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)chroman-6-amine
IUPAC Name: 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-amine
SYSTEMATIC NAME: 2,8-dimethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-amine
MOLECULAR FORMULA: C27H47NO
MOLECULAR WEIGHT: 401.66818
SMILES: CC1=C2C(=CC(=C1)N)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C
Structure:

CAS RN: 17774-72-0
CAS Name: 1,3-bis[(4-butylphenyl)methyl]imidazol-1-ium chloride
OPENEYE Name: 1,3-bis[(4-butylphenyl)methyl]imidazol-1-ium chloride
IUPAC Name: 1,3-bis[(4-butylphenyl)methyl]imidazol-1-ium chloride
SYSTEMATIC NAME: 1,3-bis[(4-butylphenyl)methyl]imidazol-1-ium chloride
MOLECULAR FORMULA: C25H33ClN2
MOLECULAR WEIGHT: 396.99592
SMILES: CCCCC1=CC=C(C=C1)CN2C=C[N+](=C2)CC3=CC=C(C=C3)CCCC.[Cl-]
Structure:

CAS RN: 17332-39-7
CAS Name: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxyisoquinolin-2-ium sulfamate
OPENEYE Name: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-isoquinolin-2-ium sulfamate
IUPAC Name: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxyisoquinolin-2-ium sulfamate
SYSTEMATIC NAME: 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-isoquinolin-2-ium sulfamate
MOLECULAR FORMULA: C24H32N2O7S
MOLECULAR WEIGHT: 492.58508
SMILES: CCOC1=C(C=C(C=C1)CC2=[NH+]C=CC3=CC(=C(C=C32)OCC)OCC)OCC.NS(=O)(=O)[O-]
Structure:

CAS RN: 16376-94-6
CAS Name: 6-azido-N4-methyl-N2-(2-methylbutan-2-yl)-1,3,5-triazine-2,4-diamine
OPENEYE Name: 6-azido-N2-(1,1-dimethylpropyl)-N4-methyl-1,3,5-triazine-2,4-diamine
IUPAC Name: 6-azido-4-N-methyl-2-N-(2-methylbutan-2-yl)-1,3,5-triazine-2,4-diamine
SYSTEMATIC NAME: 6-azido-N4-methyl-N2-(2-methylbutan-2-yl)-1,3,5-triazine-2,4-diamine
MOLECULAR FORMULA: C9H16N8
MOLECULAR WEIGHT: 236.27694
SMILES: CCC(C)(C)NC1=NC(=NC(=N1)NC)N=[N+]=[N-]
Structure:

CAS RN: 15876-57-0
CAS Name: dialuminum 2,3,4-tris(4,5-dibromo-3-oxido-6-oxo-9-xanthenyl)benzoate
OPENEYE Name: dialuminum 2,3,4-tris(4,5-dibromo-3-oxido-6-oxo-xanthen-9-yl)benzoate
IUPAC Name: dialuminum 2,3,4-tris(4,5-dibromo-3-oxido-6-oxoxanthen-9-yl)benzoate
SYSTEMATIC NAME: dialuminum 2,3,4-tris[4,5-bis(bromanyl)-3-oxidanidyl-6-oxidanylidene-xanthen-9-yl]benzoate
MOLECULAR FORMULA: C46H14Al2Br6O11+2
MOLECULAR WEIGHT: 1275.983836
SMILES: C1=CC(=C(C(=C1C2=C3C=CC(=O)C(=C3OC4=C2C=CC(=C4Br)[O-])Br)C5=C6C=CC(=O)C(=C6OC7=C5C=CC(=C7Br)[O-])Br)C8=C9C=CC(=O)C(=C9OC1=C8C=CC(=C1Br)[O-])Br)C(=O)[O-].[Al+3].[Al+3]
Structure:

CAS RN: 15122-63-1
CAS Name: aluminum bromide dihydroxide
OPENEYE Name: aluminum bromide dihydroxide
IUPAC Name: aluminum bromide dihydroxide
SYSTEMATIC NAME: aluminum bromide dihydroxide
MOLECULAR FORMULA: AlBrH2O2
MOLECULAR WEIGHT: 140.900218
SMILES: [OH-].[OH-].[Al+3].[Br-]
Structure:

CAS RN: 15060-64-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: O2PZn+
MOLECULAR WEIGHT: 128.381561
SMILES: [O-]P=O.[Zn+2]
Structure: