2-[4-(2,2-diphenylethanoyl)piperazin-1-yl]-2-pyridin-3-yl-propanenitrile

Systemtic Name: 2-[4-(2,2-diphenylethanoyl)piperazin-1-yl]-2-pyridin-3-yl-propanenitrile Openeye Name: 2-[4-(2,2-diphenylacetyl)piperazin-1-yl]-2-(3-pyridyl)propanenitrile CAS Name: 2-[4-(1-oxo-2,2-diphenylethyl)-1-piperazinyl]-2-(3-pyridinyl)propanenitrile IUPAC Name: 2-[4-(2,2-diphenylacetyl)piperazin-1-yl]-2-pyridin-3-ylpropanenitrile Traditional Name: 2-[4-(2,2-diphenylacetyl)piperazino]-2-(3-pyridyl)propionitrile Formula: C26H26N4O MolecularWeight: 410.51084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CN=CC=C1)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C#N)(C1=CN=CC=C1)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O/c1-26(20-27,23-13-8-14-28-19-23)30-17-15-29(16-18-30)25(31)24(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-14,19,24H,15-18H2,1H3