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

Systemtic Name: (E)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-3-quinoxalin-2-yl-prop-2-enenitrile Openeye Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-quinoxalin-2-yl-prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-oxomethyl]-3-(2-quinoxalinyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-prop-2-enylpyrrole-3-carbonyl)-3-quinoxalin-2-ylprop-2-enenitrile Traditional Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-quinoxalin-2-yl-acrylonitrile Formula: C21H18N4O MolecularWeight: 342.39382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)C(=CC2=NC3=CC=CC=C3N=C2)C#N

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)/C(=C/C2=NC3=CC=CC=C3N=C2)/C#N

InChI

InChI=1S/C21H18N4O/c1-4-9-25-14(2)10-18(15(25)3)21(26)16(12-22)11-17-13-23-19-7-5-6-8-20(19)24-17/h4-8,10-11,13H,1,9H2,2-3H3/b16-11+