CAS RN: 551-48-4
CAS Name: 2-[2-(2,6-dichlorophenoxy)ethylamino]guanidine sulfate
OPENEYE Name: 2-[2-(2,6-dichlorophenoxy)ethylamino]guanidine sulfate
IUPAC Name: 2-[2-(2,6-dichlorophenoxy)ethylamino]guanidine sulfate
SYSTEMATIC NAME: 2-[2-[2,6-bis(chloranyl)phenoxy]ethylamino]guanidine sulfate
MOLECULAR FORMULA: C18H24Cl4N8O6S-2
MOLECULAR WEIGHT: 622.31016
SMILES: C1=CC(=C(C(=C1)Cl)OCCNN=C(N)N)Cl.C1=CC(=C(C(=C1)Cl)OCCNN=C(N)N)Cl.[O-]S(=O)(=O)[O-]
Structure:
CAS RN: 538-17-0
CAS Name: aluminum trithiocyanate
OPENEYE Name: aluminum trithiocyanate
IUPAC Name: aluminum trithiocyanate
SYSTEMATIC NAME: aluminum trithiocyanate
MOLECULAR FORMULA: C3AlN3S3
MOLECULAR WEIGHT: 201.228738
SMILES: C(#N)[S-].C(#N)[S-].C(#N)[S-].[Al+3]
Structure:
CAS RN: 537-03-1
CAS Name: lanthanum(3+); oxalate
OPENEYE Name: lanthanum(3+); oxalate
IUPAC Name: lanthanum(3+); oxalate
SYSTEMATIC NAME: ethanedioate; lanthanum(3+)
MOLECULAR FORMULA: C6La2O12
MOLECULAR WEIGHT: 541.868
SMILES: C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[La+3].[La+3]
Structure:
CAS RN: 131530-68-2
CAS Name: lanthanum(3+); oxalate
OPENEYE Name: lanthanum(3+); oxalate
IUPAC Name: lanthanum(3+); oxalate
SYSTEMATIC NAME: ethanedioate; lanthanum(3+)
MOLECULAR FORMULA: C6La2O12
MOLECULAR WEIGHT: 541.868
SMILES: C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[La+3].[La+3]
Structure:
CAS RN: 534-87-2
CAS Name: 3-[2-(ethylamino)-1-hydroxyethyl]phenol hydrochloride
OPENEYE Name: 3-[2-(ethylamino)-1-hydroxy-ethyl]phenol hydrochloride
IUPAC Name: 3-[2-(ethylamino)-1-hydroxyethyl]phenol hydrochloride
SYSTEMATIC NAME: 3-[2-(ethylamino)-1-oxidanyl-ethyl]phenol hydrochloride
MOLECULAR FORMULA: C10H16ClNO2
MOLECULAR WEIGHT: 217.69254
SMILES: CCNCC(C1=CC(=CC=C1)O)O.Cl
Structure:
CAS RN: 943-17-9
CAS Name: 3-[2-(ethylamino)-1-hydroxyethyl]phenol hydrochloride
OPENEYE Name: 3-[2-(ethylamino)-1-hydroxy-ethyl]phenol hydrochloride
IUPAC Name: 3-[2-(ethylamino)-1-hydroxyethyl]phenol hydrochloride
SYSTEMATIC NAME: 3-[2-(ethylamino)-1-oxidanyl-ethyl]phenol hydrochloride
MOLECULAR FORMULA: C10H16ClNO2
MOLECULAR WEIGHT: 217.69254
SMILES: CCNCC(C1=CC(=CC=C1)O)O.Cl
Structure:
CAS RN: 533-01-7
CAS Name: copper dibenzoate
OPENEYE Name: copper dibenzoate
IUPAC Name: copper dibenzoate
SYSTEMATIC NAME: copper dibenzoate
MOLECULAR FORMULA: C14H10CuO4
MOLECULAR WEIGHT: 305.7728
SMILES: C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Cu+2]
Structure:
CAS RN: 532-31-0
CAS Name: silver benzoate
OPENEYE Name: silver benzoate
IUPAC Name: silver benzoate
SYSTEMATIC NAME: silver benzoate
MOLECULAR FORMULA: C7H5AgO2
MOLECULAR WEIGHT: 228.9816
SMILES: C1=CC=C(C=C1)C(=O)[O-].[Ag+]
Structure:
CAS RN: 57269-28-0
CAS Name: 1-[3-methoxy-4-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]phenyl]ethanone
OPENEYE Name: 1-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]ethanone
IUPAC Name: 1-[3-methoxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]ethanone
SYSTEMATIC NAME: 1-[4-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-methoxy-phenyl]ethanone
MOLECULAR FORMULA: C15H20O8
MOLECULAR WEIGHT: 328.3145
SMILES: CC(=O)C1=CC(=C(C=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)OC
Structure:
CAS RN: 1471-96-1
CAS Name: 6-ethyl-1,4,5,7,8-pentahydroxynaphthalene-2,3-dione
OPENEYE Name: 6-ethyl-1,4,5,7,8-pentahydroxy-naphthalene-2,3-dione
IUPAC Name: 6-ethyl-1,4,5,7,8-pentahydroxynaphthalene-2,3-dione
SYSTEMATIC NAME: 6-ethyl-1,4,5,7,8-pentakis(oxidanyl)naphthalene-2,3-dione
MOLECULAR FORMULA: C12H10O7
MOLECULAR WEIGHT: 266.2036
SMILES: CCC1=C(C2=C(C(=O)C(=O)C(=C2C(=C1O)O)O)O)O
Structure:
CAS RN: 515-25-3
CAS Name: (2S,4R)-4-hydroxy-1,1-dimethyl-2-pyrrolidin-1-iumcarboxylate
OPENEYE Name: (2S,4R)-4-hydroxy-1,1-dimethyl-pyrrolidin-1-ium-2-carboxylate
IUPAC Name: (2S,4R)-4-hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylate
SYSTEMATIC NAME: (2S,4R)-1,1-dimethyl-4-oxidanyl-pyrrolidin-1-ium-2-carboxylate
MOLECULAR FORMULA: C7H13NO3
MOLECULAR WEIGHT: 159.18302
SMILES: C[N+]1(C[C@@H](C[C@H]1C(=O)[O-])O)C
Structure:
CAS RN: 52495-41-7
CAS Name: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
OPENEYE Name: (5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(1R,4S)-1,4,5-trimethylhexyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
IUPAC Name: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
SYSTEMATIC NAME: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
MOLECULAR FORMULA: C28H50
MOLECULAR WEIGHT: 386.6966
SMILES: C[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C
Structure:
CAS RN: 25318-39-2
CAS Name: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
OPENEYE Name: (5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(1R,4S)-1,4,5-trimethylhexyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
IUPAC Name: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
SYSTEMATIC NAME: (5R,8R,9S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
MOLECULAR FORMULA: C28H50
MOLECULAR WEIGHT: 386.6966
SMILES: C[C@H](CC[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCCC4)C)C
Structure:
CAS RN: 5456-67-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H41N5O5
MOLECULAR WEIGHT: 575.69844
SMILES: CC(C)C[C@@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O
Structure:
CAS RN: 5456-32-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H19NO3
MOLECULAR WEIGHT: 285.33766
SMILES: CC1CC2C3=C(C1)C=NC(=CC34CC(=O)C=C[C@@H]4O2)OC
Structure:
CAS RN: 5454-32-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H46O
MOLECULAR WEIGHT: 386.65354
SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H]([C@@]45[C@@]3(CC[C@@H]4C5)C)O)C
Structure:
CAS RN: 502-22-7
CAS Name: 2-(3-phenylprop-1-ynyl)furan
OPENEYE Name: 2-(3-phenylprop-1-ynyl)furan
IUPAC Name: 2-(3-phenylprop-1-ynyl)furan
SYSTEMATIC NAME: 2-(3-phenylprop-1-ynyl)furan
MOLECULAR FORMULA: C13H10O
MOLECULAR WEIGHT: 182.2179
SMILES: C1=CC=C(C=C1)CC#CC2=CC=CO2
Structure:
CAS RN: 5449-79-6
CAS Name: (2S)-1-[(2S)-2-piperidinyl]-2-propanol
OPENEYE Name: (2S)-1-[(2S)-2-piperidyl]propan-2-ol
IUPAC Name: (2S)-1-[(2S)-piperidin-2-yl]propan-2-ol
SYSTEMATIC NAME: (2S)-1-[(2S)-piperidin-2-yl]propan-2-ol
MOLECULAR FORMULA: C8H17NO
MOLECULAR WEIGHT: 143.22668
SMILES: C[C@@H](C[C@@H]1CCCCN1)O
Structure:
CAS RN: 13147-26-7
CAS Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid
OPENEYE Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)-3-hydroxy-propanoic acid
IUPAC Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)-3-hydroxypropanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-3-[3,4-bis(oxidanyl)phenyl]-3-oxidanyl-propanoic acid
MOLECULAR FORMULA: C9H11NO5
MOLECULAR WEIGHT: 213.18734
SMILES: C1=CC(=C(C=C1C([C@@H](C(=O)O)N)O)O)O
Structure:
CAS RN: 491-97-4
CAS Name: [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl phosphono hydrogen phosphate
OPENEYE Name: [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl phosphono hydrogen phosphate
IUPAC Name: [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphono hydrogen phosphate
SYSTEMATIC NAME: [(2R,3S,5R)-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl phosphono hydrogen phosphate
MOLECULAR FORMULA: C10H16N2O11P2
MOLECULAR WEIGHT: 402.188362
SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)O)O
Structure:
CAS RN: 488-15-3
CAS Name: 2-hydroxy-3-methylpentanoic acid
OPENEYE Name: 2-hydroxy-3-methyl-pentanoic acid
IUPAC Name: 2-hydroxy-3-methylpentanoic acid
SYSTEMATIC NAME: 3-methyl-2-oxidanyl-pentanoic acid
MOLECULAR FORMULA: C6H12O3
MOLECULAR WEIGHT: 132.15768
SMILES: CCC(C)C(C(=O)O)O
Structure:
CAS RN: 5444-81-5
CAS Name: (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methylbutanoic acid [(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methyl-butanoate
IUPAC Name: [(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2S)-2-hydroxy-2-[(1R)-1-hydroxyethyl]-3-methylbutanoate
SYSTEMATIC NAME: [(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2S)-3-methyl-2-oxidanyl-2-[(1R)-1-oxidanylethyl]butanoate
MOLECULAR FORMULA: C15H27NO4
MOLECULAR WEIGHT: 285.37918
SMILES: C[C@H]([C@@](C(C)C)(C(=O)OC[C@@H]1CCN2[C@@H]1CCC2)O)O
Structure:
CAS RN: 5444-27-9
CAS Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
OPENEYE Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
IUPAC Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
SYSTEMATIC NAME: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
MOLECULAR FORMULA: C7H14O6
MOLECULAR WEIGHT: 194.18246
SMILES: COC1[C@@H]([C@H](C([C@@H]([C@@H]1O)O)O)O)O
Structure:
CAS RN: 10284-63-6
CAS Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
OPENEYE Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
IUPAC Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
SYSTEMATIC NAME: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
MOLECULAR FORMULA: C7H14O6
MOLECULAR WEIGHT: 194.18246
SMILES: COC1[C@@H]([C@H](C([C@@H]([C@@H]1O)O)O)O)O
Structure:
CAS RN: 484-68-4
CAS Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
OPENEYE Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
IUPAC Name: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
SYSTEMATIC NAME: (1R,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
MOLECULAR FORMULA: C7H14O6
MOLECULAR WEIGHT: 194.18246
SMILES: COC1[C@@H]([C@H](C([C@@H]([C@@H]1O)O)O)O)O
Structure:
CAS RN: 5442-23-9
CAS Name: (3aR,5R,5aR,8aR,9S)-9-hydroxy-1,5,8a-trimethyl-4,5,5a,9-tetrahydro-3aH-azuleno[6,7-b]furan-2,8-dione
OPENEYE Name: (3aR,5R,5aR,8aR,9S)-9-hydroxy-1,5,8a-trimethyl-4,5,5a,9-tetrahydro-3aH-azuleno[6,7-b]furan-2,8-dione
IUPAC Name: (3aR,5R,5aR,8aR,9S)-9-hydroxy-1,5,8a-trimethyl-4,5,5a,9-tetrahydro-3aH-azuleno[6,7-b]furan-2,8-dione
SYSTEMATIC NAME: (3aR,5R,5aR,8aR,9S)-1,5,8a-trimethyl-9-oxidanyl-4,5,5a,9-tetrahydro-3aH-azuleno[6,7-b]furan-2,8-dione
MOLECULAR FORMULA: C15H18O4
MOLECULAR WEIGHT: 262.30102
SMILES: C[C@@H]1C[C@@H]2C(=C(C(=O)O2)C)[C@@H]([C@]3([C@H]1C=CC3=O)C)O
Structure:
CAS RN: 5440-75-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H21NO4
MOLECULAR WEIGHT: 315.36364
SMILES: COC1=C(C(=C2C(=C1)CC[C@@H](C3=C2C=CC(=C3)O)N)OC)OC
Structure:
CAS RN: 5440-48-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H19NO4
MOLECULAR WEIGHT: 325.35846
SMILES: CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC5=C(C=C43)OCO5)O)OC
Structure:
CAS RN: 476-33-5
CAS Name: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
OPENEYE Name: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
IUPAC Name: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
SYSTEMATIC NAME: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
MOLECULAR FORMULA: C21H23NO5
MOLECULAR WEIGHT: 369.41102
SMILES: CN1CC2=C(C=CC(=C2OC)OC)[C@@H]3[C@H]1C4=CC5=C(C=C4C[C@@H]3O)OCO5
Structure:
CAS RN: 5440-40-4
CAS Name: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
OPENEYE Name: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
IUPAC Name: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
SYSTEMATIC NAME: (4bR,5S,11bS)-1,2-dimethoxy-12-methyl-5,6,11b,13-tetrahydro-4bH-[1,3]benzodioxolo[5,6-c]phenanthridin-5-ol
MOLECULAR FORMULA: C21H23NO5
MOLECULAR WEIGHT: 369.41102
SMILES: CN1CC2=C(C=CC(=C2OC)OC)[C@@H]3[C@H]1C4=CC5=C(C=C4C[C@@H]3O)OCO5
Structure:
CAS RN: 471-09-0
CAS Name: (2R)-2-amino-3-[(4-hydroxy-2-methylbutan-2-yl)thio]propanoic acid
OPENEYE Name: (2R)-2-amino-3-(3-hydroxy-1,1-dimethyl-propyl)sulfanyl-propanoic acid
IUPAC Name: (2R)-2-amino-3-(4-hydroxy-2-methylbutan-2-yl)sulfanylpropanoic acid
SYSTEMATIC NAME: (2R)-2-azanyl-3-(2-methyl-4-oxidanyl-butan-2-yl)sulfanyl-propanoic acid
MOLECULAR FORMULA: C8H17NO3S
MOLECULAR WEIGHT: 207.29048
SMILES: CC(C)(CCO)SC[C@@H](C(=O)O)N
Structure:
CAS RN: 463-73-0
CAS Name: carbonochloridic acid
OPENEYE Name: carbonochloridic acid
IUPAC Name: carbonochloridic acid
SYSTEMATIC NAME: carbonochloridic acid
MOLECULAR FORMULA: CHClO2
MOLECULAR WEIGHT: 80.47044
SMILES: C(=O)(O)Cl
Structure:
CAS RN: 459-67-6
CAS Name: 11-[(1R)-1-cyclopent-2-enyl]undecanoic acid
OPENEYE Name: 11-[(1R)-cyclopent-2-en-1-yl]undecanoic acid
IUPAC Name: 11-[(1R)-cyclopent-2-en-1-yl]undecanoic acid
SYSTEMATIC NAME: 11-[(1R)-cyclopent-2-en-1-yl]undecanoic acid
MOLECULAR FORMULA: C16H28O2
MOLECULAR WEIGHT: 252.39232
SMILES: C1C[C@H](C=C1)CCCCCCCCCCC(=O)O
Structure:
CAS RN: 14874-10-3
CAS Name: 3-chlorobenzenediazonium tetrafluoroborate
OPENEYE Name: 3-chlorobenzenediazonium tetrafluoroborate
IUPAC Name: 3-chlorobenzenediazonium tetrafluoroborate
SYSTEMATIC NAME: 3-chloranylbenzenediazonium tetrafluoroborate
MOLECULAR FORMULA: C6H4BClF4N2
MOLECULAR WEIGHT: 226.366973
SMILES: [B-](F)(F)(F)F.C1=CC(=CC(=C1)Cl)[N+]#N
Structure:
CAS RN: 5433-83-0
CAS Name: 1-(1-methyl-2-pyrrolidinyl)-3-[(2S)-1-methyl-2-pyrrolidinyl]-2-propanone
OPENEYE Name: 1-(1-methylpyrrolidin-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]propan-2-one
IUPAC Name: 1-(1-methylpyrrolidin-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]propan-2-one
SYSTEMATIC NAME: 1-(1-methylpyrrolidin-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]propan-2-one
MOLECULAR FORMULA: C13H24N2O
MOLECULAR WEIGHT: 224.34246
SMILES: CN1CCC[C@H]1CC(=O)CC2CCCN2C
Structure:
CAS RN: 454-14-8
CAS Name: 1-(1-methyl-2-pyrrolidinyl)-3-[(2S)-1-methyl-2-pyrrolidinyl]-2-propanone
OPENEYE Name: 1-(1-methylpyrrolidin-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]propan-2-one
IUPAC Name: 1-(1-methylpyrrolidin-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]propan-2-one
SYSTEMATIC NAME: 1-(1-methylpyrrolidin-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]propan-2-one
MOLECULAR FORMULA: C13H24N2O
MOLECULAR WEIGHT: 224.34246
SMILES: CN1CCC[C@H]1CC(=O)CC2CCCN2C
Structure:
CAS RN: 53458-40-5
CAS Name: 1,1,2,2-tetrafluoro-1-(2,2,2-trifluoroethoxy)ethane
OPENEYE Name: 1,1,2,2-tetrafluoro-1-(2,2,2-trifluoroethoxy)ethane
IUPAC Name: 1,1,2,2-tetrafluoro-1-(2,2,2-trifluoroethoxy)ethane
SYSTEMATIC NAME: 1,1,2,2-tetrakis(fluoranyl)-1-[2,2,2-tris(fluoranyl)ethoxy]ethane
MOLECULAR FORMULA: C4H3F7O
MOLECULAR WEIGHT: 200.054842
SMILES: C(C(F)(F)F)OC(C(F)F)(F)F
Structure:
CAS RN: 395-35-7
CAS Name: 2-hydroxy-2-[4-(trifluoromethyl)phenyl]acetic acid
OPENEYE Name: 2-hydroxy-2-[4-(trifluoromethyl)phenyl]acetic acid
IUPAC Name: 2-hydroxy-2-[4-(trifluoromethyl)phenyl]acetic acid
SYSTEMATIC NAME: 2-oxidanyl-2-[4-(trifluoromethyl)phenyl]ethanoic acid
MOLECULAR FORMULA: C9H7F3O3
MOLECULAR WEIGHT: 220.14529
SMILES: C1=CC(=CC=C1C(C(=O)O)O)C(F)(F)F
Structure:
CAS RN: 394-31-0
CAS Name: 2-amino-5-hydroxybenzoic acid
OPENEYE Name: 2-amino-5-hydroxy-benzoic acid
IUPAC Name: 2-amino-5-hydroxybenzoic acid
SYSTEMATIC NAME: 2-azanyl-5-oxidanyl-benzoic acid
MOLECULAR FORMULA: C7H7NO3
MOLECULAR WEIGHT: 153.13538
SMILES: C1=CC(=C(C=C1O)C(=O)O)N
Structure:
CAS RN: 372-22-5
CAS Name: (2S)-2-amino-5,5,5-trifluoro-4-methylpentanoic acid
OPENEYE Name: (2S)-2-amino-5,5,5-trifluoro-4-methyl-pentanoic acid
IUPAC Name: (2S)-2-amino-5,5,5-trifluoro-4-methylpentanoic acid
SYSTEMATIC NAME: (2S)-2-azanyl-5,5,5-tris(fluoranyl)-4-methyl-pentanoic acid
MOLECULAR FORMULA: C6H10F3NO2
MOLECULAR WEIGHT: 185.14431
SMILES: CC(C[C@@H](C(=O)O)N)C(F)(F)F
Structure:
CAS RN: 367-31-7
CAS Name: 4-fluorobenzene-1,2-diamine
OPENEYE Name: 4-fluorobenzene-1,2-diamine
IUPAC Name: 4-fluorobenzene-1,2-diamine
SYSTEMATIC NAME: 4-fluoranylbenzene-1,2-diamine
MOLECULAR FORMULA: C6H7FN2
MOLECULAR WEIGHT: 126.131583
SMILES: C1=CC(=C(C=C1F)N)N
Structure:
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