Thursday, July 26, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1,8-dideuterio-9H-carbazole
CAS Name: 1,8-dideuterio-9H-carbazole
IUPAC NAME: 1,8-dideuterio-9H-carbazole
SYSTEMATIC NAME: 1,8-dideuterio-9H-carbazole
MOLECULAR FORMULA: C12H9N
MOLECULAR WEIGHT: 169.218884
SMILES: [2H]C1=C2C(=CC=C1)C3=CC=CC(=C3N2)[2H]
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Product OPENEYE NAME: 1-deuterio-9H-carbazole
CAS Name: 1-deuterio-9H-carbazole
IUPAC NAME: 1-deuterio-9H-carbazole
SYSTEMATIC NAME: 1-deuterio-9H-carbazole
MOLECULAR FORMULA: C12H9N
MOLECULAR WEIGHT: 168.212722
SMILES: [2H]C1=C2C(=CC=C1)C3=CC=CC=C3N2
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Product OPENEYE NAME: 1-(1,9-dideuteriophenothiazin-10-yl)ethanone
CAS Name: 1-(1,9-dideuterio-10-phenothiazinyl)ethanone
IUPAC NAME: 1-(1,9-dideuteriophenothiazin-10-yl)ethanone
SYSTEMATIC NAME: 1-(1,9-dideuteriophenothiazin-10-yl)ethanone
MOLECULAR FORMULA: C14H11NOS
MOLECULAR WEIGHT: 243.320564
SMILES: [2H]C1=C2C(=CC=C1)SC3=CC=CC(=C3N2C(=O)C)[2H]
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Product OPENEYE NAME: 4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1H-imidazole-5-carboxamide
CAS Name: 4-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1H-imidazole-5-carboxamide
IUPAC NAME: 4-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-imidazole-5-carboxamide
SYSTEMATIC NAME: 4-[(2S,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-1H-imidazole-5-carboxamide
MOLECULAR FORMULA: C10H15N3O7
MOLECULAR WEIGHT: 289.242
SMILES: C1=NC(=C(N1)C(=O)N)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O
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Product OPENEYE NAME: 5-carbamoyl-3-[(2R,3R,4R,5R)-3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]-1-[(4-nitrophenyl)methyl]imidazol-3-ium-4-olate
CAS Name: 5-carbamoyl-3-[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]-1-[(4-nitrophenyl)methyl]-4-imidazol-3-iumolate
IUPAC NAME: 5-carbamoyl-3-[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-1-[(4-nitrophenyl)methyl]imidazol-3-ium-4-olate
SYSTEMATIC NAME: 5-aminocarbonyl-3-[(2R,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-1-[(4-nitrophenyl)methyl]imidazol-3-ium-4-olate
MOLECULAR FORMULA: C22H24N4O11
MOLECULAR WEIGHT: 520.44616
SMILES: CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)[N+]2=CN(C(=C2[O-])C(=O)N)CC3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C)OC(=O)C
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Product OPENEYE NAME: [(2R,3R,4R,5R)-3,4-diacetoxy-5-[4-carbamoyl-5-hydroxy-3-[(4-nitrophenyl)methyl]imidazol-1-ium-1-yl]tetrahydrofuran-2-yl]methyl acetate
CAS Name: acetic acid [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[4-carbamoyl-5-hydroxy-3-[(4-nitrophenyl)methyl]-1-imidazol-1-iumyl]-2-oxolanyl]methyl ester
IUPAC NAME: [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[4-carbamoyl-5-hydroxy-3-[(4-nitrophenyl)methyl]imidazol-1-ium-1-yl]oxolan-2-yl]methyl acetate
SYSTEMATIC NAME: [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[4-aminocarbonyl-3-[(4-nitrophenyl)methyl]-5-oxidanyl-imidazol-1-ium-1-yl]oxolan-2-yl]methyl ethanoate
MOLECULAR FORMULA: C22H25N4O11+
MOLECULAR WEIGHT: 521.4541
SMILES: CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)[N+]2=CN(C(=C2O)C(=O)N)CC3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C)OC(=O)C
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Product OPENEYE NAME: 5-carbamoyl-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-[(4-nitrophenyl)methyl]imidazol-3-ium-4-olate
CAS Name: 5-carbamoyl-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-1-[(4-nitrophenyl)methyl]-4-imidazol-3-iumolate
IUPAC NAME: 5-carbamoyl-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-[(4-nitrophenyl)methyl]imidazol-3-ium-4-olate
SYSTEMATIC NAME: 5-aminocarbonyl-3-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1-[(4-nitrophenyl)methyl]imidazol-3-ium-4-olate
MOLECULAR FORMULA: C16H18N4O8
MOLECULAR WEIGHT: 394.33612
SMILES: C1=CC(=CC=C1CN2C=[N+](C(=C2C(=O)N)[O-])[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-hydroxy-3-[(4-nitrophenyl)methyl]imidazol-1-ium-4-carboxamide
CAS Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-hydroxy-3-[(4-nitrophenyl)methyl]-4-imidazol-1-iumcarboxamide
IUPAC NAME: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-hydroxy-3-[(4-nitrophenyl)methyl]imidazol-1-ium-4-carboxamide
SYSTEMATIC NAME: 1-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-3-[(4-nitrophenyl)methyl]-5-oxidanyl-imidazol-1-ium-4-carboxamide
MOLECULAR FORMULA: C16H19N4O8+
MOLECULAR WEIGHT: 395.34406
SMILES: C1=CC(=CC=C1CN2C=[N+](C(=C2C(=O)N)O)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)[N+](=O)[O-]
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Product OPENEYE NAME: methyl (2S,3S,4S,5R,6S)-3,4,5-triacetoxy-6-[5-carbamoyl-1-[(4-nitrophenyl)methyl]imidazol-4-yl]oxy-tetrahydropyran-2-carboxylate
CAS Name: (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[[5-carbamoyl-1-[(4-nitrophenyl)methyl]-4-imidazolyl]oxy]-2-oxanecarboxylic acid methyl ester
IUPAC NAME: methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[5-carbamoyl-1-[(4-nitrophenyl)methyl]imidazol-4-yl]oxyoxane-2-carboxylate
SYSTEMATIC NAME: methyl (2S,3S,4S,5R,6S)-3,4,5-triacetyloxy-6-[5-aminocarbonyl-1-[(4-nitrophenyl)methyl]imidazol-4-yl]oxy-oxane-2-carboxylate
MOLECULAR FORMULA: C24H26N4O13
MOLECULAR WEIGHT: 578.48224
SMILES: CC(=O)O[C@H]1[C@@H]([C@H](O[C@H]([C@@H]1OC(=O)C)OC2=C(N(C=N2)CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)N)C(=O)OC)OC(=O)C
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Product OPENEYE NAME: [(3aR,5R,6R,6aR)-6-acetoxy-2-[[5-[(2S,3R,4R,5R)-3,4-diacetoxy-5-(acetoxymethyl)tetrahydrofuran-2-yl]oxy-3-[(4-nitrophenyl)methyl]imidazole-4-carbonyl]amino]-2-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl acetate
CAS Name: acetic acid [(3aR,5R,6R,6aR)-6-acetyloxy-2-[[[5-[[(2S,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)-2-oxolanyl]oxy]-3-[(4-nitrophenyl)methyl]-4-imidazolyl]-oxomethyl]amino]-2-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl ester
IUPAC NAME: [(3aR,5R,6R,6aR)-6-acetyloxy-2-[[5-[(2S,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]oxy-3-[(4-nitrophenyl)methyl]imidazole-4-carbonyl]amino]-2-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl acetate
SYSTEMATIC NAME: [(3aR,5R,6R,6aR)-6-acetyloxy-2-[[5-[(2S,3R,4R,5R)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]oxy-3-[(4-nitrophenyl)methyl]imidazol-4-yl]carbonylamino]-2-methyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]methyl ethanoate
MOLECULAR FORMULA: C33H38N4O18
MOLECULAR WEIGHT: 778.67082
SMILES: CC(=O)OC[C@@H]1[C@H]([C@@H]2[C@H](O1)OC(O2)(C)NC(=O)C3=C(N=CN3CC4=CC=C(C=C4)[N+](=O)[O-])O[C@H]5[C@@H]([C@@H]([C@H](O5)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
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