CAS RN: 75593-59-8
CAS Name: potassium 3-(4-nitrophenoxy)-1-propanesulfonate
OPENEYE Name: potassium 3-(4-nitrophenoxy)propane-1-sulfonate
IUPAC Name: potassium 3-(4-nitrophenoxy)propane-1-sulfonate
SYSTEMATIC NAME: potassium 3-(4-nitrophenoxy)propane-1-sulfonate
MOLECULAR FORMULA: C9H10KNO6S
MOLECULAR WEIGHT: 299.3421
SMILES: C1=CC(=CC=C1[N+](=O)[O-])OCCCS(=O)(=O)[O-].[K+]
Structure:
CAS RN: 75522-88-2
CAS Name: 3-(N-methyl-4-nitrosoanilino)propanenitrile hydrochloride
OPENEYE Name: 3-(N-methyl-4-nitroso-anilino)propanenitrile hydrochloride
IUPAC Name: 3-(N-methyl-4-nitrosoanilino)propanenitrile hydrochloride
SYSTEMATIC NAME: 3-[methyl-(4-nitrosophenyl)amino]propanenitrile hydrochloride
MOLECULAR FORMULA: C10H12ClN3O
MOLECULAR WEIGHT: 225.67478
SMILES: CN(CCC#N)C1=CC=C(C=C1)N=O.Cl
Structure:
CAS RN: 57479-88-6
CAS Name: 2-methoxy-N-[(1-methyl-2-pyrrolidinyl)methyl]-5-sulfamoylbenzamide
OPENEYE Name: 2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-sulfamoyl-benzamide
IUPAC Name: 2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-sulfamoylbenzamide
SYSTEMATIC NAME: 2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-sulfamoyl-benzamide
MOLECULAR FORMULA: C14H21N3O4S
MOLECULAR WEIGHT: 327.39924
SMILES: CN1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC
Structure:
CAS RN: 75514-28-2
CAS Name: 2-methoxy-N-[(1-methyl-2-pyrrolidinyl)methyl]-5-sulfamoylbenzamide hydrochloride
OPENEYE Name: 2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-sulfamoyl-benzamide hydrochloride
IUPAC Name: 2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-sulfamoylbenzamide hydrochloride
SYSTEMATIC NAME: 2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]-5-sulfamoyl-benzamide hydrochloride
MOLECULAR FORMULA: C14H22ClN3O4S
MOLECULAR WEIGHT: 363.86018
SMILES: CN1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC.Cl
Structure:
CAS RN: 75512-00-4
CAS Name: 2-anilino-10H-acridin-9-one
OPENEYE Name: 2-anilino-10H-acridin-9-one
IUPAC Name: 2-anilino-10H-acridin-9-one
SYSTEMATIC NAME: 2-phenylazanyl-10H-acridin-9-one
MOLECULAR FORMULA: C19H14N2O
MOLECULAR WEIGHT: 286.32726
SMILES: C1=CC=C(C=C1)NC2=CC3=C(C=C2)NC4=CC=CC=C4C3=O
Structure:
CAS RN: 75458-20-7
CAS Name: 1-chloro-1-methylcyclododecane
OPENEYE Name: 1-chloro-1-methyl-cyclododecane
IUPAC Name: 1-chloro-1-methylcyclododecane
SYSTEMATIC NAME: 1-chloranyl-1-methyl-cyclododecane
MOLECULAR FORMULA: C13H25Cl
MOLECULAR WEIGHT: 216.7906
SMILES: CC1(CCCCCCCCCCC1)Cl
Structure:
CAS RN: 75430-97-6
CAS Name: 1-(4-nitrophenyl)-2H-tetrazol-5-one
OPENEYE Name: 1-(4-nitrophenyl)-2H-tetrazol-5-one
IUPAC Name: 1-(4-nitrophenyl)-2H-tetrazol-5-one
SYSTEMATIC NAME: 1-(4-nitrophenyl)-2H-1,2,3,4-tetrazol-5-one
MOLECULAR FORMULA: C7H5N5O3
MOLECULAR WEIGHT: 207.1463
SMILES: C1=CC(=CC=C1N2C(=O)N=NN2)[N+](=O)[O-]
Structure:
CAS RN: 75413-99-9
CAS Name: 8-tert-butyl-1,2,3,4-tetrahydroquinoline
OPENEYE Name: 8-tert-butyl-1,2,3,4-tetrahydroquinoline
IUPAC Name: 8-tert-butyl-1,2,3,4-tetrahydroquinoline
SYSTEMATIC NAME: 8-tert-butyl-1,2,3,4-tetrahydroquinoline
MOLECULAR FORMULA: C13H19N
MOLECULAR WEIGHT: 189.29666
SMILES: CC(C)(C)C1=CC=CC2=C1NCCC2
Structure:
CAS RN: 75413-98-8
CAS Name: 6-tert-butyl-1,2,3,4-tetrahydroquinoline
OPENEYE Name: 6-tert-butyl-1,2,3,4-tetrahydroquinoline
IUPAC Name: 6-tert-butyl-1,2,3,4-tetrahydroquinoline
SYSTEMATIC NAME: 6-tert-butyl-1,2,3,4-tetrahydroquinoline
MOLECULAR FORMULA: C13H19N
MOLECULAR WEIGHT: 189.29666
SMILES: CC(C)(C)C1=CC2=C(C=C1)NCCC2
Structure:
CAS RN: 75413-96-6
CAS Name: 8-tert-butylquinoline
OPENEYE Name: 8-tert-butylquinoline
IUPAC Name: 8-tert-butylquinoline
SYSTEMATIC NAME: 8-tert-butylquinoline
MOLECULAR FORMULA: C13H15N
MOLECULAR WEIGHT: 185.2649
SMILES: CC(C)(C)C1=CC=CC2=C1N=CC=C2
Structure:
CAS RN: 75411-49-3
CAS Name: acetic acid (3-methyl-1-cyclohex-2-enyl) ester
OPENEYE Name: (3-methylcyclohex-2-en-1-yl) acetate
IUPAC Name: (3-methylcyclohex-2-en-1-yl) acetate
SYSTEMATIC NAME: (3-methylcyclohex-2-en-1-yl) ethanoate
MOLECULAR FORMULA: C9H14O2
MOLECULAR WEIGHT: 154.20626
SMILES: CC1=CC(CCC1)OC(=O)C
Structure:
CAS RN: 75370-30-8
CAS Name: N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide
OPENEYE Name: N-(6-phenoxyindan-5-yl)methanesulfonamide
IUPAC Name: N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide
SYSTEMATIC NAME: N-(6-phenoxy-2,3-dihydro-1H-inden-5-yl)methanesulfonamide
MOLECULAR FORMULA: C16H17NO3S
MOLECULAR WEIGHT: 303.37608
SMILES: CS(=O)(=O)NC1=C(C=C2CCCC2=C1)OC3=CC=CC=C3
Structure:
CAS RN: 75355-65-6
CAS Name: acetic acid 4-hydroxybutan-2-yl ester
OPENEYE Name: (3-hydroxy-1-methyl-propyl) acetate
IUPAC Name: 4-hydroxybutan-2-yl acetate
SYSTEMATIC NAME: 4-oxidanylbutan-2-yl ethanoate
MOLECULAR FORMULA: C6H12O3
MOLECULAR WEIGHT: 132.15768
SMILES: CC(CCO)OC(=O)C
Structure:
CAS RN: 75348-33-3
CAS Name: 1-(3-chlorophenyl)-2-methylpiperazine
OPENEYE Name: 1-(3-chlorophenyl)-2-methyl-piperazine
IUPAC Name: 1-(3-chlorophenyl)-2-methylpiperazine
SYSTEMATIC NAME: 1-(3-chlorophenyl)-2-methyl-piperazine
MOLECULAR FORMULA: C11H15ClN2
MOLECULAR WEIGHT: 210.7032
SMILES: CC1CNCCN1C2=CC(=CC=C2)Cl
Structure:
CAS RN: 75313-88-1
CAS Name: 1-amino-4-(2-methoxyanilino)-9,10-dioxo-2-anthracenesulfonic acid
OPENEYE Name: 1-amino-4-(2-methoxyanilino)-9,10-dioxo-anthracene-2-sulfonic acid
IUPAC Name: 1-amino-4-(2-methoxyanilino)-9,10-dioxoanthracene-2-sulfonic acid
SYSTEMATIC NAME: 1-azanyl-4-[(2-methoxyphenyl)amino]-9,10-bis(oxidanylidene)anthracene-2-sulfonic acid
MOLECULAR FORMULA: C21H16N2O6S
MOLECULAR WEIGHT: 424.42654
SMILES: COC1=CC=CC=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O
Structure:
CAS RN: 75306-60-4
CAS Name: N-[2-(2-chloro-3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
OPENEYE Name: 2-tert-butoxy-N-[2-(2-chloro-3,4-dimethoxy-phenyl)ethyl]-2-(4-methoxyphenyl)ethanamine
IUPAC Name: N-[2-(2-chloro-3,4-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
SYSTEMATIC NAME: N-[2-(2-chloranyl-3,4-dimethoxy-phenyl)ethyl]-2-(4-methoxyphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanamine
MOLECULAR FORMULA: C23H32ClNO4
MOLECULAR WEIGHT: 421.95748
SMILES: CC(C)(C)OC(CNCCC1=C(C(=C(C=C1)OC)OC)Cl)C2=CC=C(C=C2)OC
Structure:
CAS RN: 75299-82-0
CAS Name: N-(4-benzamido-9,10-dioxo-1-anthracenyl)-4-(dimethylsulfamoyl)benzamide
OPENEYE Name: N-(4-benzamido-9,10-dioxo-1-anthryl)-4-(dimethylsulfamoyl)benzamide
IUPAC Name: N-(4-benzamido-9,10-dioxoanthracen-1-yl)-4-(dimethylsulfamoyl)benzamide
SYSTEMATIC NAME: N-[4-benzamido-9,10-bis(oxidanylidene)anthracen-1-yl]-4-(dimethylsulfamoyl)benzamide
MOLECULAR FORMULA: C30H23N3O6S
MOLECULAR WEIGHT: 553.58512
SMILES: CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC(=O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5C3=O
Structure:
CAS RN: 75294-00-7
CAS Name: 6,7-dichloro-3-oxo-4H-quinoxaline-2-carboxylic acid
OPENEYE Name: 6,7-dichloro-3-oxo-4H-quinoxaline-2-carboxylic acid
IUPAC Name: 6,7-dichloro-3-oxo-4H-quinoxaline-2-carboxylic acid
SYSTEMATIC NAME: 6,7-bis(chloranyl)-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid
MOLECULAR FORMULA: C9H4Cl2N2O3
MOLECULAR WEIGHT: 259.04566
SMILES: C1=C2C(=CC(=C1Cl)Cl)N=C(C(=O)N2)C(=O)O
Structure:
CAS RN: 17106-13-7
CAS Name: 2,4-dimethyl-1H-pyrrole-3-carboxylic acid
OPENEYE Name: 2,4-dimethyl-1H-pyrrole-3-carboxylic acid
IUPAC Name: 2,4-dimethyl-1H-pyrrole-3-carboxylic acid
SYSTEMATIC NAME: 2,4-dimethyl-1H-pyrrole-3-carboxylic acid
MOLECULAR FORMULA: C7H9NO2
MOLECULAR WEIGHT: 139.15186
SMILES: CC1=CNC(=C1C(=O)O)C
Structure:
CAS RN: 75203-51-9
CAS Name: oxalic acid bis[2,3,5-trichloro-6-[oxo(pentoxy)methyl]phenyl] ester
OPENEYE Name: bis(2,3,5-trichloro-6-pentoxycarbonyl-phenyl) oxalate
IUPAC Name: bis(2,3,5-trichloro-6-pentoxycarbonylphenyl) oxalate
SYSTEMATIC NAME: bis[2,3,5-tris(chloranyl)-6-pentoxycarbonyl-phenyl] ethanedioate
MOLECULAR FORMULA: C26H24Cl6O8
MOLECULAR WEIGHT: 677.18196
SMILES: CCCCCOC(=O)C1=C(C(=C(C=C1Cl)Cl)Cl)OC(=O)C(=O)OC2=C(C(=CC(=C2Cl)Cl)Cl)C(=O)OCCCCC
Structure:
CAS RN: 75202-24-3
CAS Name: 2-(4-chloro-2-tetradecylphenoxy)-N-(3,5-dichloro-2-hydroxy-4-methylphenyl)acetamide
OPENEYE Name: 2-(4-chloro-2-tetradecyl-phenoxy)-N-(3,5-dichloro-2-hydroxy-4-methyl-phenyl)acetamide
IUPAC Name: 2-(4-chloro-2-tetradecylphenoxy)-N-(3,5-dichloro-2-hydroxy-4-methylphenyl)acetamide
SYSTEMATIC NAME: N-[3,5-bis(chloranyl)-4-methyl-2-oxidanyl-phenyl]-2-(4-chloranyl-2-tetradecyl-phenoxy)ethanamide
MOLECULAR FORMULA: C29H40Cl3NO3
MOLECULAR WEIGHT: 556.9918
SMILES: CCCCCCCCCCCCCCC1=C(C=CC(=C1)Cl)OCC(=O)NC2=CC(=C(C(=C2O)Cl)C)Cl
Structure:
CAS RN: 75180-41-5
CAS Name: [1-(isothiocyanatomethyl)cyclopropyl]benzene
OPENEYE Name: [1-(isothiocyanatomethyl)cyclopropyl]benzene
IUPAC Name: [1-(isothiocyanatomethyl)cyclopropyl]benzene
SYSTEMATIC NAME: [1-(isothiocyanatomethyl)cyclopropyl]benzene
MOLECULAR FORMULA: C11H11NS
MOLECULAR WEIGHT: 189.27674
SMILES: C1CC1(CN=C=S)C2=CC=CC=C2
Structure:
CAS RN: 75166-67-5
CAS Name: 9-(2-hydroxynonan-3-yl)-3H-purin-6-one
OPENEYE Name: 9-[1-(1-hydroxyethyl)heptyl]-3H-purin-6-one
IUPAC Name: 9-(2-hydroxynonan-3-yl)-3H-purin-6-one
SYSTEMATIC NAME: 9-(2-oxidanylnonan-3-yl)-3H-purin-6-one
MOLECULAR FORMULA: C14H22N4O2
MOLECULAR WEIGHT: 278.35008
SMILES: CCCCCCC(C(C)O)N1C=NC2=C1NC=NC2=O
Structure:
CAS RN: 75150-23-1
CAS Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-2-propenamide
OPENEYE Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-methyl-prop-2-enamide
IUPAC Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methylprop-2-enamide
SYSTEMATIC NAME: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-methyl-prop-2-enamide
MOLECULAR FORMULA: C11H22N2O
MOLECULAR WEIGHT: 198.30518
SMILES: CC(=C)C(=O)NCC(C)(C)CN(C)C
Structure:
CAS RN: 68285-08-5
CAS Name: N-[4-[2-(tert-butylamino)-1-hydroxyethyl]-2-cyano-6-fluorophenyl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-cyano-6-fluoro-phenyl]carbamate hydrochloride
IUPAC Name: ethyl N-[4-[2-(tert-butylamino)-1-hydroxyethyl]-2-cyano-6-fluorophenyl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-cyano-6-fluoranyl-phenyl]carbamate hydrochloride
MOLECULAR FORMULA: C16H23ClFN3O3
MOLECULAR WEIGHT: 359.823523
SMILES: CCOC(=O)NC1=C(C=C(C=C1C#N)C(CNC(C)(C)C)O)F.Cl
Structure:
CAS RN: 75115-21-8
CAS Name: N-[4-[2-(tert-butylamino)-1-hydroxyethyl]-2-cyano-6-fluorophenyl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-cyano-6-fluoro-phenyl]carbamate hydrochloride
IUPAC Name: ethyl N-[4-[2-(tert-butylamino)-1-hydroxyethyl]-2-cyano-6-fluorophenyl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-cyano-6-fluoranyl-phenyl]carbamate hydrochloride
MOLECULAR FORMULA: C16H23ClFN3O3
MOLECULAR WEIGHT: 359.823523
SMILES: CCOC(=O)NC1=C(C=C(C=C1C#N)C(CNC(C)(C)C)O)F.Cl
Structure:
CAS RN: 75048-15-6
CAS Name: 3-methyl-1-[1-(2-methylpropoxy)ethoxy]butane
OPENEYE Name: 1-(1-isobutoxyethoxy)-3-methyl-butane
IUPAC Name: 3-methyl-1-[1-(2-methylpropoxy)ethoxy]butane
SYSTEMATIC NAME: 3-methyl-1-[1-(2-methylpropoxy)ethoxy]butane
MOLECULAR FORMULA: C11H24O2
MOLECULAR WEIGHT: 188.30706
SMILES: CC(C)CCOC(C)OCC(C)C
Structure:
CAS RN: 75032-87-0
CAS Name: carbonochloridic acid 3-methoxybutyl ester
OPENEYE Name: 3-methoxybutyl carbonochloridate
IUPAC Name: 3-methoxybutyl carbonochloridate
SYSTEMATIC NAME: 3-methoxybutyl carbonochloridate
MOLECULAR FORMULA: C6H11ClO3
MOLECULAR WEIGHT: 166.60274
SMILES: CC(CCOC(=O)Cl)OC
Structure:
CAS RN: 74972-56-8
CAS Name: hex-5-enoxybenzene
OPENEYE Name: hex-5-enoxybenzene
IUPAC Name: hex-5-enoxybenzene
SYSTEMATIC NAME: hex-5-enoxybenzene
MOLECULAR FORMULA: C12H16O
MOLECULAR WEIGHT: 176.25484
SMILES: C=CCCCCOC1=CC=CC=C1
Structure:
CAS RN: 74956-19-7
CAS Name: 3-[4-(2,6-dichloro-4-nitrophenyl)azo-N-(2-phenoxyethyl)anilino]propanenitrile
OPENEYE Name: 3-[4-(2,6-dichloro-4-nitro-phenyl)azo-N-(2-phenoxyethyl)anilino]propanenitrile
IUPAC Name: 3-[4-[(2,6-dichloro-4-nitrophenyl)diazenyl]-N-(2-phenoxyethyl)anilino]propanenitrile
SYSTEMATIC NAME: 3-[[4-[[2,6-bis(chloranyl)-4-nitro-phenyl]diazenyl]phenyl]-(2-phenoxyethyl)amino]propanenitrile
MOLECULAR FORMULA: C23H19Cl2N5O3
MOLECULAR WEIGHT: 484.33466
SMILES: C1=CC=C(C=C1)OCCN(CCC#N)C2=CC=C(C=C2)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl
Structure:
CAS RN: 74935-12-9
CAS Name: 2-(2-methylanilino)-2-(2,3,6-trichlorophenyl)acetic acid
OPENEYE Name: 2-(2-methylanilino)-2-(2,3,6-trichlorophenyl)acetic acid
IUPAC Name: 2-(2-methylanilino)-2-(2,3,6-trichlorophenyl)acetic acid
SYSTEMATIC NAME: 2-[(2-methylphenyl)amino]-2-[2,3,6-tris(chloranyl)phenyl]ethanoic acid
MOLECULAR FORMULA: C15H12Cl3NO2
MOLECULAR WEIGHT: 344.62028
SMILES: CC1=CC=CC=C1NC(C2=C(C=CC(=C2Cl)Cl)Cl)C(=O)O
Structure:
CAS RN: 74929-43-4
CAS Name: 2-(4-chloroanilino)-2-(2,6-dichlorophenyl)acetonitrile
OPENEYE Name: 2-(4-chloroanilino)-2-(2,6-dichlorophenyl)acetonitrile
IUPAC Name: 2-(4-chloroanilino)-2-(2,6-dichlorophenyl)acetonitrile
SYSTEMATIC NAME: 2-[2,6-bis(chloranyl)phenyl]-2-[(4-chlorophenyl)amino]ethanenitrile
MOLECULAR FORMULA: C14H9Cl3N2
MOLECULAR WEIGHT: 311.59366
SMILES: C1=CC(=C(C(=C1)Cl)C(C#N)NC2=CC=C(C=C2)Cl)Cl
Structure:
CAS RN: 74926-27-5
CAS Name: 2,2,12-trimethyltridecane-1,11-diamine
OPENEYE Name: 2,2,12-trimethyltridecane-1,11-diamine
IUPAC Name: 2,2,12-trimethyltridecane-1,11-diamine
SYSTEMATIC NAME: 2,2,12-trimethyltridecane-1,11-diamine
MOLECULAR FORMULA: C16H36N2
MOLECULAR WEIGHT: 256.47044
SMILES: CC(C)C(CCCCCCCCC(C)(C)CN)N
Structure:
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