[2-[(phenylmethyl)carbamoyl]phenyl] 2,5-dimethoxybenzenesulfonate

Systemtic Name: [2-[(phenylmethyl)carbamoyl]phenyl] 2,5-dimethoxybenzenesulfonate Openeye Name: [2-(benzylcarbamoyl)phenyl] 2,5-dimethoxybenzenesulfonate CAS Name: 2,5-dimethoxybenzenesulfonic acid [2-[oxo-[(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [2-(benzylcarbamoyl)phenyl] 2,5-dimethoxybenzenesulfonate Traditional Name: 2,5-dimethoxybenzenesulfonic acid [2-(benzylcarbamoyl)phenyl] ester Formula: C22H21NO6S MolecularWeight: 427.47024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)OC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)OC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H21NO6S/c1-27-17-12-13-20(28-2)21(14-17)30(25,26)29-19-11-7-6-10-18(19)22(24)23-15-16-8-4-3-5-9-16/h3-14H,15H2,1-2H3,(H,23,24)