2-phenyl-6-piperazin-1-yl-2-propan-2-yl-7-quinolin-5-yloxy-heptanenitrile

Systemtic Name: 2-phenyl-6-piperazin-1-yl-2-propan-2-yl-7-quinolin-5-yloxy-heptanenitrile Openeye Name: 2-isopropyl-2-phenyl-6-piperazin-1-yl-7-(5-quinolyloxy)heptanenitrile CAS Name: 2-phenyl-6-(1-piperazinyl)-2-propan-2-yl-7-(5-quinolinyloxy)heptanenitrile IUPAC Name: 2-phenyl-6-piperazin-1-yl-2-propan-2-yl-7-quinolin-5-yloxyheptanenitrile Traditional Name: 2-isopropyl-2-phenyl-6-piperazino-7-(5-quinolyloxy)enanthonitrile Formula: C29H36N4O MolecularWeight: 456.62234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(COC1=CC=CC2=C1C=CC=N2)N3CCNCC3)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCC(COC1=CC=CC2=C1C=CC=N2)N3CCNCC3)(C#N)C4=CC=CC=C4

InChI

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