(E)-2-cyano-3-(3-ethoxy-4-phenylmethoxy-phenyl)-N-phenethyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-ethoxy-4-phenylmethoxy-phenyl)-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-(4-benzyloxy-3-ethoxy-phenyl)-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-2-cyano-3-(3-ethoxy-4-phenylmethoxyphenyl)-N-phenethyl-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-ethoxy-4-phenylmethoxyphenyl)-N-phenethylprop-2-enamide Traditional Name: (E)-3-(4-benzoxy-3-ethoxy-phenyl)-2-cyano-N-phenethyl-acrylamide Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NCCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NCCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C27H26N2O3/c1-2-31-26-18-23(13-14-25(26)32-20-22-11-7-4-8-12-22)17-24(19-28)27(30)29-16-15-21-9-5-3-6-10-21/h3-14,17-18H,2,15-16,20H2,1H3,(H,29,30)/b24-17+