2-[(3R)-1-[2-(4-hydroxyphenyl)ethyl]piperidin-3-yl]-2,2-diphenyl-ethanenitrile

Systemtic Name: 2-[(3R)-1-[2-(4-hydroxyphenyl)ethyl]piperidin-3-yl]-2,2-diphenyl-ethanenitrile Openeye Name: 2-[(3R)-1-[2-(4-hydroxyphenyl)ethyl]-3-piperidyl]-2,2-diphenyl-acetonitrile CAS Name: 2-[(3R)-1-[2-(4-hydroxyphenyl)ethyl]-3-piperidinyl]-2,2-diphenylacetonitrile IUPAC Name: 2-[(3R)-1-[2-(4-hydroxyphenyl)ethyl]piperidin-3-yl]-2,2-diphenylacetonitrile Traditional Name: 2-[(3R)-1-[2-(4-hydroxyphenyl)ethyl]-3-piperidyl]-2,2-diphenyl-acetonitrile Formula: C27H28N2O MolecularWeight: 396.52402

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC2=CC=C(C=C2)O)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)CCC2=CC=C(C=C2)O)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O/c28-21-27(23-8-3-1-4-9-23,24-10-5-2-6-11-24)25-12-7-18-29(20-25)19-17-22-13-15-26(30)16-14-22/h1-6,8-11,13-16,25,30H,7,12,17-20H2/t25-/m0/s1