2-[4-[(3E)-3-ethoxyimino-3-phenyl-propyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[(3E)-3-ethoxyimino-3-phenyl-propyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[(3E)-3-ethoxyimino-3-phenyl-propyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[(3E)-3-ethoxyimino-3-phenylpropyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[(3E)-3-ethoxyimino-3-phenylpropyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[(3E)-3-ethyloximino-3-phenyl-propyl]piperazino]nicotinonitrile Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C(CCN1CCN(CC1)C2=C(C=CC=N2)C#N)C3=CC=CC=C3

Isomeric SMILES

CCO/N=C(\CCN1CCN(CC1)C2=C(C=CC=N2)C#N)/C3=CC=CC=C3

InChI

InChI=1S/C21H25N5O/c1-2-27-24-20(18-7-4-3-5-8-18)10-12-25-13-15-26(16-14-25)21-19(17-22)9-6-11-23-21/h3-9,11H,2,10,12-16H2,1H3/b24-20+