2-[4-[2-[(diphenylmethyl)amino]ethyl]piperazin-1-yl]-2-pyridin-4-yl-ethanenitrile chloride

Systemtic Name: 2-[4-[2-[(diphenylmethyl)amino]ethyl]piperazin-1-yl]-2-pyridin-4-yl-ethanenitrile chloride Openeye Name: 2-[4-[2-(benzhydrylamino)ethyl]piperazin-1-yl]-2-(4-pyridyl)acetonitrile chloride CAS Name: 2-[4-[2-[(diphenylmethyl)amino]ethyl]-1-piperazinyl]-2-pyridin-4-ylacetonitrile chloride IUPAC Name: 2-[4-[2-(benzhydrylamino)ethyl]piperazin-1-yl]-2-pyridin-4-ylacetonitrile chloride Traditional Name: 2-[4-[2-(benzhydrylamino)ethyl]piperazino]-2-(4-pyridyl)acetonitrile chloride Formula: C26H29ClN5- MolecularWeight: 446.99496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C4=CC=NC=C4.[Cl-]

Isomeric SMILES

C1CN(CCN1CCNC(C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C4=CC=NC=C4.[Cl-]

InChI

InChI=1S/C26H29N5.ClH/c27-21-25(22-11-13-28-14-12-22)31-19-17-30(18-20-31)16-15-29-26(23-7-3-1-4-8-23)24-9-5-2-6-10-24;/h1-14,25-26,29H,15-20H2;1H/p-1