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

Systemtic Name: [1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Openeye Name: [2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3,4-dimethoxyphenyl)-2-propenoic acid [1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-cyanoanilino)-1-oxopropan-2-yl] (E)-3-(3,4-dimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3,4-dimethoxyphenyl)acrylic acid [2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)C=CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)/C=C/C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H20N2O5/c1-14(21(25)23-17-7-5-4-6-16(17)13-22)28-20(24)11-9-15-8-10-18(26-2)19(12-15)27-3/h4-12,14H,1-3H3,(H,23,25)/b11-9+