2-phenyl-2-propan-2-yl-5-[4-[2-(3-pyridin-3-ylphenoxy)ethyl]piperazin-1-yl]pentanenitrile

Systemtic Name: 2-phenyl-2-propan-2-yl-5-[4-[2-(3-pyridin-3-ylphenoxy)ethyl]piperazin-1-yl]pentanenitrile Openeye Name: 2-isopropyl-2-phenyl-5-[4-[2-[3-(3-pyridyl)phenoxy]ethyl]piperazin-1-yl]pentanenitrile CAS Name: 2-phenyl-2-propan-2-yl-5-[4-[2-[3-(3-pyridinyl)phenoxy]ethyl]-1-piperazinyl]pentanenitrile IUPAC Name: 2-phenyl-2-propan-2-yl-5-[4-[2-(3-pyridin-3-ylphenoxy)ethyl]piperazin-1-yl]pentanenitrile Traditional Name: 2-isopropyl-2-phenyl-5-[4-[2-[3-(3-pyridyl)phenoxy]ethyl]piperazino]valeronitrile Formula: C31H38N4O MolecularWeight: 482.65962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=CC(=C2)C3=CN=CC=C3)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=CC(=C2)C3=CN=CC=C3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C31H38N4O/c1-26(2)31(25-32,29-11-4-3-5-12-29)14-8-16-34-17-19-35(20-18-34)21-22-36-30-13-6-9-27(23-30)28-10-7-15-33-24-28/h3-7,9-13,15,23-24,26H,8,14,16-22H2,1-2H3