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

Systemtic Name: 4-[(E)-3-(4-tert-butylphenyl)-3-oxidanylidene-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Openeye Name: 4-[(E)-3-(4-tert-butylphenyl)-3-oxo-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile CAS Name: 4-[(E)-3-(4-tert-butylphenyl)-3-oxoprop-1-enyl]-1,5-dimethyl-2-pyrrolecarbonitrile IUPAC Name: 4-[(E)-3-(4-tert-butylphenyl)-3-oxoprop-1-enyl]-1,5-dimethylpyrrole-2-carbonitrile Traditional Name: 4-[(E)-3-(4-tert-butylphenyl)-3-keto-prop-1-enyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)C=CC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(N1C)C#N)/C=C/C(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H22N2O/c1-14-16(12-18(13-21)22(14)5)8-11-19(23)15-6-9-17(10-7-15)20(2,3)4/h6-12H,1-5H3/b11-8+