2-phenyl-2-propan-2-yl-5-[4-(2-pyridin-4-yloxyethyl)piperazin-1-yl]pentanenitrile

Systemtic Name: 2-phenyl-2-propan-2-yl-5-[4-(2-pyridin-4-yloxyethyl)piperazin-1-yl]pentanenitrile Openeye Name: 2-isopropyl-2-phenyl-5-[4-[2-(4-pyridyloxy)ethyl]piperazin-1-yl]pentanenitrile CAS Name: 2-phenyl-2-propan-2-yl-5-[4-(2-pyridin-4-yloxyethyl)-1-piperazinyl]pentanenitrile IUPAC Name: 2-phenyl-2-propan-2-yl-5-[4-(2-pyridin-4-yloxyethyl)piperazin-1-yl]pentanenitrile Traditional Name: 2-isopropyl-2-phenyl-5-[4-[2-(4-pyridyloxy)ethyl]piperazino]valeronitrile Formula: C25H34N4O MolecularWeight: 406.56366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=NC=C2)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=NC=C2)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C25H34N4O/c1-22(2)25(21-26,23-7-4-3-5-8-23)11-6-14-28-15-17-29(18-16-28)19-20-30-24-9-12-27-13-10-24/h3-5,7-10,12-13,22H,6,11,14-20H2,1-2H3