2-[(E)-[1-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propylidene]amino]oxyethanenitrile

Systemtic Name: 2-[(E)-[1-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propylidene]amino]oxyethanenitrile Openeye Name: 2-[(E)-[1-phenyl-3-[4-(2-pyridyl)piperazin-1-yl]propylidene]amino]oxyacetonitrile CAS Name: 2-[(E)-[1-phenyl-3-[4-(2-pyridinyl)-1-piperazinyl]propylidene]amino]oxyacetonitrile IUPAC Name: 2-[(E)-[1-phenyl-3-(4-pyridin-2-ylpiperazin-1-yl)propylidene]amino]oxyacetonitrile Traditional Name: 2-[(E)-[1-phenyl-3-[4-(2-pyridyl)piperazino]propylidene]amino]oxyacetonitrile Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=NOCC#N)C2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

C1CN(CCN1CC/C(=N\OCC#N)/C2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C20H23N5O/c21-10-17-26-23-19(18-6-2-1-3-7-18)9-12-24-13-15-25(16-14-24)20-8-4-5-11-22-20/h1-8,11H,9,12-17H2/b23-19+