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

Systemtic Name: methyl 2-azanyl-4-(4-bromophenyl)-5-oxidanylidene-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 2-amino-4-(4-bromophenyl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: 2-amino-4-(4-bromophenyl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(4-bromophenyl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: 2-amino-4-(4-bromophenyl)-5-keto-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C23H22BrN3O5S MolecularWeight: 532.40688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)Br)C(=O)CCC2)C4=CC=C(C=C4)S(=O)(=O)N)N

Isomeric SMILES

COC(=O)C1=C(N(C2=C(C1C3=CC=C(C=C3)Br)C(=O)CCC2)C4=CC=C(C=C4)S(=O)(=O)N)N

InChI

InChI=1S/C23H22BrN3O5S/c1-32-23(29)21-19(13-5-7-14(24)8-6-13)20-17(3-2-4-18(20)28)27(22(21)25)15-9-11-16(12-10-15)33(26,30)31/h5-12,19H,2-4,25H2,1H3,(H2,26,30,31)