4-[5-tert-butyl-2-[4-(quinolin-2-ylmethoxy)piperidin-1-yl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[5-tert-butyl-2-[4-(quinolin-2-ylmethoxy)piperidin-1-yl]phenyl]benzenecarbonitrile Openeye Name: 4-[5-tert-butyl-2-[4-(2-quinolylmethoxy)-1-piperidyl]phenyl]benzonitrile CAS Name: 4-[5-tert-butyl-2-[4-(2-quinolinylmethoxy)-1-piperidinyl]phenyl]benzonitrile IUPAC Name: 4-[5-tert-butyl-2-[4-(quinolin-2-ylmethoxy)piperidin-1-yl]phenyl]benzonitrile Traditional Name: 4-[5-tert-butyl-2-[4-(2-quinolylmethoxy)piperidino]phenyl]benzonitrile Formula: C32H33N3O MolecularWeight: 475.62392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)N2CCC(CC2)OCC3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)C#N

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)N2CCC(CC2)OCC3=NC4=CC=CC=C4C=C3)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C32H33N3O/c1-32(2,3)26-13-15-31(29(20-26)24-10-8-23(21-33)9-11-24)35-18-16-28(17-19-35)36-22-27-14-12-25-6-4-5-7-30(25)34-27/h4-15,20,28H,16-19,22H2,1-3H3