4-[1-(4-cyano-4,4-diphenyl-butyl)-4-oxidanyl-piperidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[1-(4-cyano-4,4-diphenyl-butyl)-4-oxidanyl-piperidin-4-yl]benzenecarbonitrile Openeye Name: 4-[1-(4-cyano-4,4-diphenyl-butyl)-4-hydroxy-4-piperidyl]benzonitrile CAS Name: 4-[1-(4-cyano-4,4-diphenylbutyl)-4-hydroxy-4-piperidinyl]benzonitrile IUPAC Name: 4-[1-(4-cyano-4,4-diphenylbutyl)-4-hydroxypiperidin-4-yl]benzonitrile Traditional Name: 4-[1-(4-cyano-4,4-diphenyl-butyl)-4-hydroxy-4-piperidyl]benzonitrile Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)C#N)O)CCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)C#N)O)CCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O/c30-22-24-12-14-27(15-13-24)29(33)17-20-32(21-18-29)19-7-16-28(23-31,25-8-3-1-4-9-25)26-10-5-2-6-11-26/h1-6,8-15,33H,7,16-21H2