[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(2,4-dimethoxyphenyl)prop-2-enoate

Systemtic Name: [2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(2,4-dimethoxyphenyl)prop-2-enoate Openeye Name: [2-(3-bromoanilino)-2-oxo-ethyl] (E)-3-(2,4-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,4-dimethoxyphenyl)-2-propenoic acid [2-(3-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromoanilino)-2-oxoethyl] (E)-3-(2,4-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2,4-dimethoxyphenyl)acrylic acid [2-(3-bromoanilino)-2-keto-ethyl] ester Formula: C19H18BrNO5 MolecularWeight: 420.25392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)OCC(=O)NC2=CC(=CC=C2)Br)OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C(=O)OCC(=O)NC2=CC(=CC=C2)Br)OC

InChI

InChI=1S/C19H18BrNO5/c1-24-16-8-6-13(17(11-16)25-2)7-9-19(23)26-12-18(22)21-15-5-3-4-14(20)10-15/h3-11H,12H2,1-2H3,(H,21,22)/b9-7+