3-[(E)-3-(3-methylpiperidin-1-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 3-[(E)-3-(3-methylpiperidin-1-yl)-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 3-[(E)-3-(3-methyl-1-piperidyl)-3-oxo-prop-1-enyl]benzonitrile CAS Name: 3-[(E)-3-(3-methyl-1-piperidinyl)-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 3-[(E)-3-(3-methylpiperidin-1-yl)-3-oxoprop-1-enyl]benzonitrile Traditional Name: 3-[(E)-3-keto-3-(3-methylpiperidino)prop-1-enyl]benzonitrile Formula: C16H18N2O MolecularWeight: 254.32692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C=CC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1CCCN(C1)C(=O)/C=C/C2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H18N2O/c1-13-4-3-9-18(12-13)16(19)8-7-14-5-2-6-15(10-14)11-17/h2,5-8,10,13H,3-4,9,12H2,1H3/b8-7+