[4-[(E)-3-[benzamido(propan-2-yl)amino]-3-oxidanylidene-prop-1-enyl]phenyl] methanesulfonate

Systemtic Name: [4-[(E)-3-[benzamido(propan-2-yl)amino]-3-oxidanylidene-prop-1-enyl]phenyl] methanesulfonate Openeye Name: [4-[(E)-3-[benzamido(isopropyl)amino]-3-oxo-prop-1-enyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[(E)-3-[benzamido(propan-2-yl)amino]-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-[benzamido(propan-2-yl)amino]-3-oxoprop-1-enyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[(E)-3-[benzamido(isopropyl)amino]-3-keto-prop-1-enyl]phenyl] ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)C=CC1=CC=C(C=C1)OS(=O)(=O)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)N(C(=O)/C=C/C1=CC=C(C=C1)OS(=O)(=O)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H22N2O5S/c1-15(2)22(21-20(24)17-7-5-4-6-8-17)19(23)14-11-16-9-12-18(13-10-16)27-28(3,25)26/h4-15H,1-3H3,(H,21,24)/b14-11+