(E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(2-prop-2-ynoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(2-prop-2-ynoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(2-propargyloxyphenyl)acrylamide Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CC=CC=C2OCC#C)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)/C(=C/C2=CC=CC=C2OCC#C)/C#N)OC

InChI

InChI=1S/C21H18N2O4/c1-4-11-27-18-8-6-5-7-15(18)12-16(14-22)21(24)23-17-9-10-19(25-2)20(13-17)26-3/h1,5-10,12-13H,11H2,2-3H3,(H,23,24)/b16-12+