[1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate

Systemtic Name: [1-[(4-aminocarbonylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate Openeye Name: [2-(4-carbamoylanilino)-1-methyl-2-oxo-ethyl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,3-dimethoxyphenyl)-2-propenoic acid [1-(4-carbamoylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-carbamoylanilino)-1-oxopropan-2-yl] (E)-3-(2,3-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(2,3-dimethoxyphenyl)acrylic acid [2-(4-carbamoylanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)OC(=O)C=CC2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)OC(=O)/C=C/C2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C21H22N2O6/c1-13(21(26)23-16-10-7-15(8-11-16)20(22)25)29-18(24)12-9-14-5-4-6-17(27-2)19(14)28-3/h4-13H,1-3H3,(H2,22,25)(H,23,26)/b12-9+