[2-(methylamino)-2-oxidanylidene-ethyl] (E)-3-[3-methoxy-4-(4-methylphenyl)sulfonyloxy-phenyl]prop-2-enoate

Systemtic Name: [2-(methylamino)-2-oxidanylidene-ethyl] (E)-3-[3-methoxy-4-(4-methylphenyl)sulfonyloxy-phenyl]prop-2-enoate Openeye Name: [2-(methylamino)-2-oxo-ethyl] (E)-3-[3-methoxy-4-(p-tolylsulfonyloxy)phenyl]prop-2-enoate CAS Name: (E)-3-[3-methoxy-4-(4-methylphenyl)sulfonyloxyphenyl]-2-propenoic acid [2-(methylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylamino)-2-oxoethyl] (E)-3-[3-methoxy-4-(4-methylphenyl)sulfonyloxyphenyl]prop-2-enoate Traditional Name: (E)-3-(3-methoxy-4-tosyloxy-phenyl)acrylic acid [2-keto-2-(methylamino)ethyl] ester Formula: C20H21NO7S MolecularWeight: 419.44824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=CC(=O)OCC(=O)NC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)/C=C/C(=O)OCC(=O)NC)OC

InChI

InChI=1S/C20H21NO7S/c1-14-4-8-16(9-5-14)29(24,25)28-17-10-6-15(12-18(17)26-3)7-11-20(23)27-13-19(22)21-2/h4-12H,13H2,1-3H3,(H,21,22)/b11-7+