1,5-dimethyl-4-[(E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-enyl]pyrrole-2-carbonitrile

Systemtic Name: 1,5-dimethyl-4-[(E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-enyl]pyrrole-2-carbonitrile Openeye Name: 1,5-dimethyl-4-[(E)-3-oxo-3-(p-tolyl)prop-1-enyl]pyrrole-2-carbonitrile CAS Name: 1,5-dimethyl-4-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]-2-pyrrolecarbonitrile IUPAC Name: 1,5-dimethyl-4-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]pyrrole-2-carbonitrile Traditional Name: 4-[(E)-3-keto-3-(p-tolyl)prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C17H16N2O MolecularWeight: 264.32174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=C(N(C(=C2)C#N)C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O/c1-12-4-6-14(7-5-12)17(20)9-8-15-10-16(11-18)19(3)13(15)2/h4-10H,1-3H3/b9-8+