(E)-2-(3-methylphenyl)carbonyl-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(3-methylphenyl)carbonyl-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(3-methylbenzoyl)-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(3-methylphenyl)-oxomethyl]-3-(2,3,4-trimethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(3-methylbenzoyl)-3-(2,3,4-trimethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-m-toluoyl-3-(2,3,4-trimethoxyphenyl)acrylonitrile Formula: C20H19NO4 MolecularWeight: 337.36916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(=CC2=C(C(=C(C=C2)OC)OC)OC)C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)/C(=C/C2=C(C(=C(C=C2)OC)OC)OC)/C#N

InChI

InChI=1S/C20H19NO4/c1-13-6-5-7-14(10-13)18(22)16(12-21)11-15-8-9-17(23-2)20(25-4)19(15)24-3/h5-11H,1-4H3/b16-11+