[3-[(phenylmethyl)carbamoyl]phenyl] 3-methylquinoline-8-sulfonate

Systemtic Name: [3-[(phenylmethyl)carbamoyl]phenyl] 3-methylquinoline-8-sulfonate Openeye Name: [3-(benzylcarbamoyl)phenyl] 3-methylquinoline-8-sulfonate CAS Name: 3-methyl-8-quinolinesulfonic acid [3-[oxo-[(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [3-(benzylcarbamoyl)phenyl] 3-methylquinoline-8-sulfonate Traditional Name: 3-methylquinoline-8-sulfonic acid [3-(benzylcarbamoyl)phenyl] ester Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O4S/c1-17-13-19-9-6-12-22(23(19)25-15-17)31(28,29)30-21-11-5-10-20(14-21)24(27)26-16-18-7-3-2-4-8-18/h2-15H,16H2,1H3,(H,26,27)