(prop-2-enoylamino)methyl 4-methylbenzenesulfonate

Systemtic Name: (prop-2-enoylamino)methyl 4-methylbenzenesulfonate Openeye Name: (prop-2-enoylamino)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-oxoprop-2-enylamino)methyl ester IUPAC Name: (prop-2-enoylamino)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid acrylamidomethyl ester Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCNC(=O)C=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCNC(=O)C=C

InChI

InChI=1S/C11H13NO4S/c1-3-11(13)12-8-16-17(14,15)10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3,(H,12,13)