(E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(4-methylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(4-methylphenyl)prop-2-enenitrile Openeye Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(p-tolyl)prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-propyl-3-pyrrolyl)-oxomethyl]-3-(4-methylphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-propylpyrrole-3-carbonyl)-3-(4-methylphenyl)prop-2-enenitrile Traditional Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(p-tolyl)acrylonitrile Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)C(=CC2=CC=C(C=C2)C)C#N)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)/C(=C/C2=CC=C(C=C2)C)/C#N)C

InChI

InChI=1S/C20H22N2O/c1-5-10-22-15(3)11-19(16(22)4)20(23)18(13-21)12-17-8-6-14(2)7-9-17/h6-9,11-12H,5,10H2,1-4H3/b18-12+