2-phenyl-2-propan-2-yl-5-[4-(2-quinolin-6-yloxyethyl)piperazin-1-yl]pentanenitrile

Systemtic Name: 2-phenyl-2-propan-2-yl-5-[4-(2-quinolin-6-yloxyethyl)piperazin-1-yl]pentanenitrile Openeye Name: 2-isopropyl-2-phenyl-5-[4-[2-(6-quinolyloxy)ethyl]piperazin-1-yl]pentanenitrile CAS Name: 2-phenyl-2-propan-2-yl-5-[4-[2-(6-quinolinyloxy)ethyl]-1-piperazinyl]pentanenitrile IUPAC Name: 2-phenyl-2-propan-2-yl-5-[4-(2-quinolin-6-yloxyethyl)piperazin-1-yl]pentanenitrile Traditional Name: 2-isopropyl-2-phenyl-5-[4-[2-(6-quinolyloxy)ethyl]piperazino]valeronitrile Formula: C29H36N4O MolecularWeight: 456.62234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC3=C(C=C2)N=CC=C3)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC3=C(C=C2)N=CC=C3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C29H36N4O/c1-24(2)29(23-30,26-9-4-3-5-10-26)13-7-15-32-16-18-33(19-17-32)20-21-34-27-11-12-28-25(22-27)8-6-14-31-28/h3-6,8-12,14,22,24H,7,13,15-21H2,1-2H3