[2-(phenylmethoxycarbonylamino)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(phenylmethoxycarbonylamino)phenyl] 4-methylbenzenesulfonate Openeye Name: [2-(benzyloxycarbonylamino)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(phenylmethoxycarbonylamino)phenyl] ester IUPAC Name: [2-(phenylmethoxycarbonylamino)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(benzyloxycarbonylamino)phenyl] ester Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H19NO5S/c1-16-11-13-18(14-12-16)28(24,25)27-20-10-6-5-9-19(20)22-21(23)26-15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,22,23)