[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(3,5-dimethoxyphenyl)prop-2-enoate

Systemtic Name: [2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(3,5-dimethoxyphenyl)prop-2-enoate Openeye Name: [2-(3-acetamidoanilino)-2-oxo-ethyl] (E)-3-(3,5-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3,5-dimethoxyphenyl)-2-propenoic acid [2-(3-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-acetamidoanilino)-2-oxoethyl] (E)-3-(3,5-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,5-dimethoxyphenyl)acrylic acid [2-(3-acetamidoanilino)-2-keto-ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)C=CC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)COC(=O)/C=C/C2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C21H22N2O6/c1-14(24)22-16-5-4-6-17(11-16)23-20(25)13-29-21(26)8-7-15-9-18(27-2)12-19(10-15)28-3/h4-12H,13H2,1-3H3,(H,22,24)(H,23,25)/b8-7+