methyl (4S)-2-azanyl-4-(4-nitrophenyl)-5-oxidanylidene-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl (4S)-2-azanyl-4-(4-nitrophenyl)-5-oxidanylidene-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl (4S)-2-amino-4-(4-nitrophenyl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: (4S)-2-amino-4-(4-nitrophenyl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-2-amino-4-(4-nitrophenyl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4S)-2-amino-5-keto-4-(4-nitrophenyl)-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C23H22N4O7S MolecularWeight: 498.50838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)[N+](=O)[O-])C(=O)CCC2)C4=CC=C(C=C4)S(=O)(=O)N)N

Isomeric SMILES

COC(=O)C1=C(N(C2=C([C@@H]1C3=CC=C(C=C3)[N+](=O)[O-])C(=O)CCC2)C4=CC=C(C=C4)S(=O)(=O)N)N

InChI

InChI=1S/C23H22N4O7S/c1-34-23(29)21-19(13-5-7-15(8-6-13)27(30)31)20-17(3-2-4-18(20)28)26(22(21)24)14-9-11-16(12-10-14)35(25,32)33/h5-12,19H,2-4,24H2,1H3,(H2,25,32,33)/t19-/m0/s1