(E)-N-(4-chlorophenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(4-chlorophenyl)-2-cyano-3-(3-ethoxy-4-propargyloxy-phenyl)acrylamide Formula: C21H17ClN2O3 MolecularWeight: 380.82428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC=C(C=C2)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)Cl)OCC#C

InChI

InChI=1S/C21H17ClN2O3/c1-3-11-27-19-10-5-15(13-20(19)26-4-2)12-16(14-23)21(25)24-18-8-6-17(22)7-9-18/h1,5-10,12-13H,4,11H2,2H3,(H,24,25)/b16-12+