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

Systemtic Name: 2-phenyl-2-propan-2-yl-5-[4-[2-(4-pyridin-3-ylphenoxy)ethyl]piperazin-1-yl]pentanenitrile Openeye Name: 2-isopropyl-2-phenyl-5-[4-[2-[4-(3-pyridyl)phenoxy]ethyl]piperazin-1-yl]pentanenitrile CAS Name: 2-phenyl-2-propan-2-yl-5-[4-[2-[4-(3-pyridinyl)phenoxy]ethyl]-1-piperazinyl]pentanenitrile IUPAC Name: 2-phenyl-2-propan-2-yl-5-[4-[2-(4-pyridin-3-ylphenoxy)ethyl]piperazin-1-yl]pentanenitrile Traditional Name: 2-isopropyl-2-phenyl-5-[4-[2-[4-(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=C(C=C2)C3=CN=CC=C3)(C#N)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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