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

Systemtic Name: methyl 2-azanyl-4-(1,3-benzodioxol-5-yl)-5-oxidanylidene-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-keto-1-(4-sulfamoylphenyl)-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C24H23N3O7S MolecularWeight: 497.52032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=C(C1C3=CC4=C(C=C3)OCO4)C(=O)CCC2)C5=CC=C(C=C5)S(=O)(=O)N)N

Isomeric SMILES

COC(=O)C1=C(N(C2=C(C1C3=CC4=C(C=C3)OCO4)C(=O)CCC2)C5=CC=C(C=C5)S(=O)(=O)N)N

InChI

InChI=1S/C24H23N3O7S/c1-32-24(29)22-20(13-5-10-18-19(11-13)34-12-33-18)21-16(3-2-4-17(21)28)27(23(22)25)14-6-8-15(9-7-14)35(26,30)31/h5-11,20H,2-4,12,25H2,1H3,(H2,26,30,31)