(E)-2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-3-(4-phenylmethoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-3-(4-phenylmethoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)-3-(4-benzyloxyphenyl)prop-2-enenitrile CAS Name: (E)-2-[(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-oxomethyl]-3-(4-phenylmethoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)-3-(4-phenylmethoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)-3-(4-benzoxyphenyl)acrylonitrile Formula: C25H22N2O3 MolecularWeight: 398.45378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)/C(=C/C2=CC=C(C=C2)OCC3=CC=CC=C3)/C#N

InChI

InChI=1S/C25H22N2O3/c1-16-23(18(3)28)17(2)27-24(16)25(29)21(14-26)13-19-9-11-22(12-10-19)30-15-20-7-5-4-6-8-20/h4-13,27H,15H2,1-3H3/b21-13+