(E)-3-(3-ethoxy-2-propoxy-phenyl)-2-(2-methylphenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3-ethoxy-2-propoxy-phenyl)-2-(2-methylphenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(3-ethoxy-2-propoxy-phenyl)-2-(2-methylbenzoyl)prop-2-enenitrile CAS Name: (E)-3-(3-ethoxy-2-propoxyphenyl)-2-[(2-methylphenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3-ethoxy-2-propoxyphenyl)-2-(2-methylbenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(3-ethoxy-2-propoxy-phenyl)-2-o-toluoyl-acrylonitrile Formula: C22H23NO3 MolecularWeight: 349.42292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1OCC)C=C(C#N)C(=O)C2=CC=CC=C2C

Isomeric SMILES

CCCOC1=C(C=CC=C1OCC)/C=C(\C#N)/C(=O)C2=CC=CC=C2C

InChI

InChI=1S/C22H23NO3/c1-4-13-26-22-17(10-8-12-20(22)25-5-2)14-18(15-23)21(24)19-11-7-6-9-16(19)3/h6-12,14H,4-5,13H2,1-3H3/b18-14+