3-(phenylmethoxycarbonylamino)propyl 4-methylbenzenesulfonate

Systemtic Name: 3-(phenylmethoxycarbonylamino)propyl 4-methylbenzenesulfonate Openeye Name: 3-(benzyloxycarbonylamino)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(phenylmethoxycarbonylamino)propyl ester IUPAC Name: 3-(phenylmethoxycarbonylamino)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(benzyloxycarbonylamino)propyl ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO5S/c1-15-8-10-17(11-9-15)25(21,22)24-13-5-12-19-18(20)23-14-16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3,(H,19,20)