(E)-3-(3,5-dimethoxyphenyl)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(3,5-dimethoxyphenyl)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(3,5-dimethoxyphenyl)prop-2-enenitrile CAS Name: (E)-3-(3,5-dimethoxyphenyl)-2-[(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(3,5-dimethoxyphenyl)-2-(2,5-dimethyl-1-prop-2-enylpyrrole-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(3,5-dimethoxyphenyl)acrylonitrile Formula: C21H22N2O3 MolecularWeight: 350.41098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)C(=CC2=CC(=CC(=C2)OC)OC)C#N

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)/C(=C/C2=CC(=CC(=C2)OC)OC)/C#N

InChI

InChI=1S/C21H22N2O3/c1-6-7-23-14(2)8-20(15(23)3)21(24)17(13-22)9-16-10-18(25-4)12-19(11-16)26-5/h6,8-12H,1,7H2,2-5H3/b17-9+