2-[(E)-3-(4-methyl-2-phenyl-piperazin-1-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 2-[(E)-3-(4-methyl-2-phenyl-piperazin-1-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 2-[(E)-3-(4-methyl-2-phenyl-piperazin-1-yl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 2-[(E)-3-(4-methyl-2-phenyl-1-piperazinyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 2-[(E)-3-(4-methyl-2-phenylpiperazin-1-yl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 2-[(E)-3-keto-3-(4-methyl-2-phenyl-piperazino)prop-1-enyl]benzonitrile Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2=CC=CC=C2)C(=O)C=CC3=CC=CC=C3C#N

Isomeric SMILES

CN1CCN(C(C1)C2=CC=CC=C2)C(=O)/C=C/C3=CC=CC=C3C#N

InChI

InChI=1S/C21H21N3O/c1-23-13-14-24(20(16-23)18-8-3-2-4-9-18)21(25)12-11-17-7-5-6-10-19(17)15-22/h2-12,20H,13-14,16H2,1H3/b12-11+