Monday, June 27, 2011

http://ChemLookup.com Compounds




CAS RN: 93882-48-5
CAS Name: (E)-2-eicosenoic acid [(E)-octadec-1-enyl] ester
OPENEYE Name: [(E)-octadec-1-enyl] (E)-icos-2-enoate
IUPAC Name: [(E)-octadec-1-enyl] (E)-icos-2-enoate
SYSTEMATIC NAME: [(E)-octadec-1-enyl] (E)-icos-2-enoate
MOLECULAR FORMULA: C38H72O2
MOLECULAR WEIGHT: 560.97708
SMILES: CCCCCCCCCCCCCCCCC/C=C/C(=O)O/C=C/CCCCCCCCCCCCCCCC

CAS RN: 93882-47-4
CAS Name: (E)-2-eicosenoic acid octadecyl ester
OPENEYE Name: octadecyl (E)-icos-2-enoate
IUPAC Name: octadecyl (E)-icos-2-enoate
SYSTEMATIC NAME: octadecyl (E)-icos-2-enoate
MOLECULAR FORMULA: C38H74O2
MOLECULAR WEIGHT: 562.99296
SMILES: CCCCCCCCCCCCCCCCCCOC(=O)/C=C/CCCCCCCCCCCCCCCCC

CAS RN: 93882-46-3
CAS Name: (E)-2-eicosenoic acid eicosyl ester
OPENEYE Name: icosyl (E)-icos-2-enoate
IUPAC Name: icosyl (E)-icos-2-enoate
SYSTEMATIC NAME: icosyl (E)-icos-2-enoate
MOLECULAR FORMULA: C40H78O2
MOLECULAR WEIGHT: 591.04612
SMILES: CCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/CCCCCCCCCCCCCCCCC

CAS RN: 93882-45-2
CAS Name: (E)-2-eicosenoic acid hexadecyl ester
OPENEYE Name: hexadecyl (E)-icos-2-enoate
IUPAC Name: hexadecyl (E)-icos-2-enoate
SYSTEMATIC NAME: hexadecyl (E)-icos-2-enoate
MOLECULAR FORMULA: C36H70O2
MOLECULAR WEIGHT: 534.9398
SMILES: CCCCCCCCCCCCCCCCC/C=C/C(=O)OCCCCCCCCCCCCCCCC

CAS RN: 93882-43-0
CAS Name: (E)-2-hexadecenoic acid eicosyl ester
OPENEYE Name: icosyl (E)-hexadec-2-enoate
IUPAC Name: icosyl (E)-hexadec-2-enoate
SYSTEMATIC NAME: icosyl (E)-hexadec-2-enoate
MOLECULAR FORMULA: C36H70O2
MOLECULAR WEIGHT: 534.9398
SMILES: CCCCCCCCCCCCCCCCCCCCOC(=O)/C=C/CCCCCCCCCCCCC

CAS RN: 93882-28-1
CAS Name: potassium (E)-2-undecenoate
OPENEYE Name: potassium (E)-undec-2-enoate
IUPAC Name: potassium (E)-undec-2-enoate
SYSTEMATIC NAME: potassium (E)-undec-2-enoate
MOLECULAR FORMULA: C11H19KO2
MOLECULAR WEIGHT: 222.36566
SMILES: CCCCCCCC/C=C/C(=O)[O-].[K+]

CAS RN: 75522-94-0
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C48H34N9Na3O19S4
MOLECULAR WEIGHT: 1238.06177
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=C3O)N=NC4=C(C=C(C=C4)C5=CC(=C(C=C5)N=NC6=C(C=C7C(=C6O)C=CC(=C7N=NC8=C(C=C(C=C8)[N+](=O)[O-])C(=O)[O-])N)S(=O)(=O)[O-])OC)OC)S(=O)(=O)O.[Na+].[Na+].[Na+]

CAS RN: 85136-26-1
CAS Name: disodium 5-[4-(3-chloro-2-hydroxypropoxy)phenyl]azo-2-[(E)-2-[4-[4-(3-chloro-2-hydroxypropoxy)phenyl]azo-2-sulfonatophenyl]ethenyl]benzenesulfonate
OPENEYE Name: disodium 5-[4-(3-chloro-2-hydroxy-propoxy)phenyl]azo-2-[(E)-2-[4-[4-(3-chloro-2-hydroxy-propoxy)phenyl]azo-2-sulfonato-phenyl]vinyl]benzenesulfonate
IUPAC Name: disodium 5-[[4-(3-chloro-2-hydroxypropoxy)phenyl]diazenyl]-2-[(E)-2-[4-[[4-(3-chloro-2-hydroxypropoxy)phenyl]diazenyl]-2-sulfonatophenyl]ethenyl]benzenesulfonate
SYSTEMATIC NAME: disodium 5-[[4-(3-chloranyl-2-oxidanyl-propoxy)phenyl]diazenyl]-2-[(E)-2-[4-[[4-(3-chloranyl-2-oxidanyl-propoxy)phenyl]diazenyl]-2-sulfonato-phenyl]ethenyl]benzenesulfonate
MOLECULAR FORMULA: C32H28Cl2N4Na2O10S2
MOLECULAR WEIGHT: 809.60106
SMILES: C1=CC(=CC=C1N=NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)N=NC4=CC=C(C=C4)OCC(CCl)O)S(=O)(=O)[O-])S(=O)(=O)[O-])OCC(CCl)O.[Na+].[Na+]

CAS RN: 1913-28-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H28O3
MOLECULAR WEIGHT: 328.44522
SMILES: CC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@@H]3C4C2CCC5=CC(=O)CC[C@]45CO3)C

CAS RN: 23622-57-3
CAS Name: 4-[4-[anilino(oxo)methyl]phenyl]azo-5-oxo-1-phenyl-4H-pyrazole-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 5-oxo-1-phenyl-4-[4-(phenylcarbamoyl)phenyl]azo-4H-pyrazole-3-carboxylate
IUPAC Name: ethyl 5-oxo-1-phenyl-4-[[4-(phenylcarbamoyl)phenyl]diazenyl]-4H-pyrazole-3-carboxylate
SYSTEMATIC NAME: ethyl 5-oxidanylidene-1-phenyl-4-[[4-(phenylcarbamoyl)phenyl]diazenyl]-4H-pyrazole-3-carboxylate
MOLECULAR FORMULA: C25H21N5O4
MOLECULAR WEIGHT: 455.46534
SMILES: CCOC(=O)C1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C4=CC=CC=C4

CAS RN: 22615-60-7
CAS Name: azanide; chlororuthenium; nitroxyl anion; dichloride
OPENEYE Name: azanide; chlororuthenium; nitroxyl anion; dichloride
IUPAC Name: azanide; chlororuthenium; nitroxyl anion; dichloride
SYSTEMATIC NAME: azanide; chloranylruthenium; oxoazanide; dichloride
MOLECULAR FORMULA: Cl3H8N5ORu-7
MOLECULAR WEIGHT: 301.52542
SMILES: [NH2-].[NH2-].[NH2-].[NH2-].[N-]=O.[Cl-].[Cl-].Cl[Ru]

CAS RN: 89425-94-5
CAS Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]-2-heptenoic acid
OPENEYE Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-2-enoic acid
IUPAC Name: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-2-enoic acid
SYSTEMATIC NAME: (E)-7-[4-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxan-5-yl]hept-2-enoic acid
MOLECULAR FORMULA: C19H26O5
MOLECULAR WEIGHT: 334.40674
SMILES: CC1(OCC(C(O1)C2=CC=CC=C2O)CCCC/C=C/C(=O)O)C

CAS RN: 89285-03-0
CAS Name: acetic acid [3-[[(4-amino-2-methyl-5-pyrimidinyl)methylamino]-sulfanylidenemethoxy]-4-oxopentyl] ester carbamothioate
OPENEYE Name: [3-[(4-amino-2-methyl-pyrimidin-5-yl)methylcarbamothioyloxy]-4-oxo-pentyl] acetate carbamothioate
IUPAC Name: [3-[(4-amino-2-methylpyrimidin-5-yl)methylcarbamothioyloxy]-4-oxopentyl] acetate carbamothioate
SYSTEMATIC NAME: [3-[(4-azanyl-2-methyl-pyrimidin-5-yl)methylcarbamothioyloxy]-4-oxidanylidene-pentyl] ethanoate carbamothioate
MOLECULAR FORMULA: C15H22N5O5S2-
MOLECULAR WEIGHT: 416.49568
SMILES: CC1=NC=C(C(=N1)N)CNC(=S)OC(CCOC(=O)C)C(=O)C.C(=S)(N)[O-]

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