4-[[4-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[(E)-2-cyano-3-(p-tolyl)prop-2-enoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(E)-2-cyano-3-(4-methylphenyl)-1-oxoprop-2-enyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[(E)-2-cyano-3-(4-methylphenyl)prop-2-enoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[(E)-2-cyano-3-(p-tolyl)acryloyl]piperazino]methyl]benzonitrile Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H22N4O/c1-18-2-4-19(5-3-18)14-22(16-25)23(28)27-12-10-26(11-13-27)17-21-8-6-20(15-24)7-9-21/h2-9,14H,10-13,17H2,1H3/b22-14+