(E)-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-(phenylcarbonyl)prop-2-enenitrile

Systemtic Name: (E)-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-(phenylcarbonyl)prop-2-enenitrile Openeye Name: (E)-2-benzoyl-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]prop-2-enenitrile CAS Name: (E)-2-benzoyl-3-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-2-propenenitrile IUPAC Name: (E)-2-benzoyl-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]prop-2-enenitrile Traditional Name: (E)-2-benzoyl-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]acrylonitrile Formula: C23H20N2O MolecularWeight: 340.4177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C(C#N)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)/C=C(\C#N)/C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H20N2O/c1-16-9-11-22(12-10-16)25-17(2)13-20(18(25)3)14-21(15-24)23(26)19-7-5-4-6-8-19/h4-14H,1-3H3/b21-14+