methyl 4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonate

Systemtic Name: methyl 4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonate Openeye Name: methyl 3-(benzyloxycarbonylamino)-4-methyl-benzenesulfonate CAS Name: 4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonic acid methyl ester IUPAC Name: methyl 4-methyl-3-(phenylmethoxycarbonylamino)benzenesulfonate Traditional Name: 3-(benzyloxycarbonylamino)-4-methyl-benzenesulfonic acid methyl ester Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H17NO5S/c1-12-8-9-14(23(19,20)21-2)10-15(12)17-16(18)22-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,17,18)