1-[(2E)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinolin-4-yl]piperidine-4-carbonitrile

Systemtic Name: 1-[(2E)-2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinolin-4-yl]piperidine-4-carbonitrile Openeye Name: 1-[(2E)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinolin-4-yl]piperidine-4-carbonitrile CAS Name: 1-[(2E)-2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinolin-4-yl]-4-piperidinecarbonitrile IUPAC Name: 1-[(2E)-2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinolin-4-yl]piperidine-4-carbonitrile Traditional Name: 1-[(2E)-2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-quinolin-4-yl]isonipecotonitrile Formula: C21H19N3O MolecularWeight: 329.39506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)C2=CC(=C3C=CC=CC3=O)NC4=CC=CC=C42

Isomeric SMILES

C1CN(CCC1C#N)C2=C/C(=C\3/C=CC=CC3=O)/NC4=CC=CC=C42

InChI

InChI=1S/C21H19N3O/c22-14-15-9-11-24(12-10-15)20-13-19(17-6-2-4-8-21(17)25)23-18-7-3-1-5-16(18)20/h1-8,13,15,23H,9-12H2/b19-17+