2-(phenylcarbamoylamino)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(phenylcarbamoylamino)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(phenylcarbamoylamino)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[[anilino(oxo)methyl]amino]ethyl ester IUPAC Name: 2-(phenylcarbamoylamino)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(phenylcarbamoylamino)ethyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCNC(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCNC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O4S/c1-13-7-9-15(10-8-13)23(20,21)22-12-11-17-16(19)18-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H2,17,18,19)