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

Systemtic Name: (E)-2-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)carbonyl-3-(2-methylphenyl)prop-2-enenitrile Openeye Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(o-tolyl)prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-oxomethyl]-3-(2-methylphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-prop-2-enylpyrrole-3-carbonyl)-3-(2-methylphenyl)prop-2-enenitrile Traditional Name: (E)-2-(1-allyl-2,5-dimethyl-pyrrole-3-carbonyl)-3-(o-tolyl)acrylonitrile Formula: C20H20N2O MolecularWeight: 304.3856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C(C#N)C(=O)C2=C(N(C(=C2)C)CC=C)C

Isomeric SMILES

CC1=CC=CC=C1/C=C(\C#N)/C(=O)C2=C(N(C(=C2)C)CC=C)C

InChI

InChI=1S/C20H20N2O/c1-5-10-22-15(3)11-19(16(22)4)20(23)18(13-21)12-17-9-7-6-8-14(17)2/h5-9,11-12H,1,10H2,2-4H3/b18-12+