Saturday, July 21, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-[(8-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
CAS Name: 2-[(8-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
IUPAC NAME: 2-[(8-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
SYSTEMATIC NAME: 2-[(8-azanyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
MOLECULAR FORMULA: C9H12N4O2
MOLECULAR WEIGHT: 208.21718
SMILES: C1=CN2C(=NC(=N2)COCCO)C(=C1)N
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Product OPENEYE NAME: 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
CAS Name: benzoic acid 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl ester
IUPAC NAME: 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
SYSTEMATIC NAME: 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
MOLECULAR FORMULA: C16H14N4O5
MOLECULAR WEIGHT: 342.30616
SMILES: C1=CC=C(C=C1)C(=O)OCCOCC2=NN3C=C(C=CC3=N2)[N+](=O)[O-]
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Product OPENEYE NAME: 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
CAS Name: 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
IUPAC NAME: 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
SYSTEMATIC NAME: 2-[(6-nitro-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
MOLECULAR FORMULA: C9H10N4O4
MOLECULAR WEIGHT: 238.2001
SMILES: C1=CC2=NC(=NN2C=C1[N+](=O)[O-])COCCO
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Product OPENEYE NAME: 2-[(6-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
CAS Name: benzoic acid 2-[(6-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl ester
IUPAC NAME: 2-[(6-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
SYSTEMATIC NAME: 2-[(6-azanyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethyl benzoate
MOLECULAR FORMULA: C16H16N4O3
MOLECULAR WEIGHT: 312.32324
SMILES: C1=CC=C(C=C1)C(=O)OCCOCC2=NN3C=C(C=CC3=N2)N
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Product OPENEYE NAME: 2-amino-8-(2-hydroxyethoxymethyl)-3,7-dihydropurin-6-one
CAS Name: 2-amino-8-(2-hydroxyethoxymethyl)-3,7-dihydropurin-6-one
IUPAC NAME: 2-amino-8-(2-hydroxyethoxymethyl)-3,7-dihydropurin-6-one
SYSTEMATIC NAME: 2-azanyl-8-(2-hydroxyethyloxymethyl)-3,7-dihydropurin-6-one
MOLECULAR FORMULA: C8H11N5O3
MOLECULAR WEIGHT: 225.20464
SMILES: C(COCC1=NC2=C(N1)C(=O)N=C(N2)N)O
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Product OPENEYE NAME: 2-[(6-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
CAS Name: 2-[(6-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
IUPAC NAME: 2-[(6-amino-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
SYSTEMATIC NAME: 2-[(6-azanyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methoxy]ethanol
MOLECULAR FORMULA: C9H12N4O2
MOLECULAR WEIGHT: 208.21718
SMILES: C1=CC2=NC(=NN2C=C1N)COCCO
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Product OPENEYE NAME: 2-(2-benzylsulfanyl-2-imino-ethoxy)ethyl benzoate
CAS Name: benzoic acid 2-[2-imino-2-(phenylmethylthio)ethoxy]ethyl ester
IUPAC NAME: 2-(2-benzylsulfanyl-2-iminoethoxy)ethyl benzoate
SYSTEMATIC NAME: 2-[2-azanylidene-2-(phenylmethylsulfanyl)ethoxy]ethyl benzoate
MOLECULAR FORMULA: C18H19NO3S
MOLECULAR WEIGHT: 329.41336
SMILES: C1=CC=C(C=C1)CSC(=N)COCCOC(=O)C2=CC=CC=C2
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Product OPENEYE NAME: 2-[(4-amino-5-carbamoyl-1H-imidazol-2-yl)methoxy]ethyl benzoate
CAS Name: benzoic acid 2-[(4-amino-5-carbamoyl-1H-imidazol-2-yl)methoxy]ethyl ester
IUPAC NAME: 2-[(4-amino-5-carbamoyl-1H-imidazol-2-yl)methoxy]ethyl benzoate
SYSTEMATIC NAME: 2-[(5-aminocarbonyl-4-azanyl-1H-imidazol-2-yl)methoxy]ethyl benzoate
MOLECULAR FORMULA: C14H16N4O4
MOLECULAR WEIGHT: 304.30124
SMILES: C1=CC=C(C=C1)C(=O)OCCOCC2=NC(=C(N2)C(=O)N)N
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Product OPENEYE NAME: ethyl N-[(1R,2S,3R,4S)-2-(hydroxymethyl)-3-bicyclo[2.2.1]hept-5-enyl]carbamate
CAS Name: N-[(1R,2S,3R,4S)-2-(hydroxymethyl)-3-bicyclo[2.2.1]hept-5-enyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[(1R,2S,3R,4S)-2-(hydroxymethyl)-3-bicyclo[2.2.1]hept-5-enyl]carbamate
SYSTEMATIC NAME: ethyl N-[(1R,2S,3R,4S)-2-(hydroxymethyl)-3-bicyclo[2.2.1]hept-5-enyl]carbamate
MOLECULAR FORMULA: C11H17NO3
MOLECULAR WEIGHT: 211.25758
SMILES: CCOC(=O)N[C@@H]1[C@H]2C[C@@H]([C@@H]1CO)C=C2
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Product OPENEYE NAME: (Z)-2-[2-[4-(chloromethyl)-2-phenyl-1,3-dioxolan-2-yl]benzoyl]-3-(dimethylamino)prop-2-enenitrile
CAS Name: (Z)-2-[[2-[4-(chloromethyl)-2-phenyl-1,3-dioxolan-2-yl]phenyl]-oxomethyl]-3-(dimethylamino)-2-propenenitrile
IUPAC NAME: (Z)-2-[2-[4-(chloromethyl)-2-phenyl-1,3-dioxolan-2-yl]benzoyl]-3-(dimethylamino)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-[2-[4-(chloromethyl)-2-phenyl-1,3-dioxolan-2-yl]phenyl]carbonyl-3-(dimethylamino)prop-2-enenitrile
MOLECULAR FORMULA: C22H21ClN2O3
MOLECULAR WEIGHT: 396.86674
SMILES: CN(C)/C=C(/C#N)\C(=O)C1=CC=CC=C1C2(OCC(O2)CCl)C3=CC=CC=C3
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H15N
MOLECULAR WEIGHT: 221.297
SMILES: C1CC2=CC=CC=C2N3CCC4=CC=CC1=C43
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Product OPENEYE NAME:
CAS Name:
IUPAC NAME:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H13N
MOLECULAR WEIGHT: 219.28112
SMILES: C1CN2C3=CC=CC=C3C=CC4=C2C1=CC=C4
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Product OPENEYE NAME: N-methyl-N-[1-[2-(p-tolyl)ethyl]pentoxy]methanamine
CAS Name: N-methyl-N-[1-(4-methylphenyl)heptan-3-yloxy]methanamine
IUPAC NAME: N-methyl-N-[1-(4-methylphenyl)heptan-3-yloxy]methanamine
SYSTEMATIC NAME: N-methyl-N-[1-(4-methylphenyl)heptan-3-yloxy]methanamine
MOLECULAR FORMULA: C16H27NO
MOLECULAR WEIGHT: 249.39168
SMILES: CCCCC(CCC1=CC=C(C=C1)C)ON(C)C
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Product OPENEYE NAME: 5-butyl-2,2-dimethyl-3-(p-tolyl)isoxazolidin-2-ium
CAS Name: 5-butyl-2,2-dimethyl-3-(4-methylphenyl)isoxazolidin-2-ium
IUPAC NAME: 5-butyl-2,2-dimethyl-3-(4-methylphenyl)-1,2-oxazolidin-2-ium
SYSTEMATIC NAME: 5-butyl-2,2-dimethyl-3-(4-methylphenyl)-1,2-oxazolidin-2-ium
MOLECULAR FORMULA: C16H26NO+
MOLECULAR WEIGHT: 248.38374
SMILES: CCCCC1CC([N+](O1)(C)C)C2=CC=C(C=C2)C
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