(6E)-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-2-piperazin-1-yl-4-piperidin-3-yl-1H-pyridine-3-carbonitrile dihydrochloride

Systemtic Name: (6E)-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-2-piperazin-1-yl-4-piperidin-3-yl-1H-pyridine-3-carbonitrile dihydrochloride Openeye Name: (6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-2-piperazin-1-yl-4-(3-piperidyl)-1H-pyridine-3-carbonitrile dihydrochloride CAS Name: (6E)-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-2-(1-piperazinyl)-4-(3-piperidinyl)-1H-pyridine-3-carbonitrile dihydrochloride IUPAC Name: (6E)-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-2-piperazin-1-yl-4-piperidin-3-yl-1H-pyridine-3-carbonitrile dihydrochloride Traditional Name: (6E)-6-(6-ketocyclohexa-2,4-dien-1-ylidene)-2-piperazino-4-(3-piperidyl)-1H-pyridine-3-carbonitrile dihydrochloride Formula: C21H27Cl2N5O MolecularWeight: 436.37798

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C2=CC(=C3C=CC=CC3=O)NC(=C2C#N)N4CCNCC4.Cl.Cl

Isomeric SMILES

C1CC(CNC1)C2=C/C(=C\3/C=CC=CC3=O)/NC(=C2C#N)N4CCNCC4.Cl.Cl

InChI

InChI=1S/C21H25N5O.2ClH/c22-13-18-17(15-4-3-7-24-14-15)12-19(16-5-1-2-6-20(16)27)25-21(18)26-10-8-23-9-11-26;;/h1-2,5-6,12,15,23-25H,3-4,7-11,14H2;2*1H/b19-16+;;