4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-2-yl]-2,2-diphenyl-butanenitrile

Systemtic Name: 4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-2-yl]-2,2-diphenyl-butanenitrile Openeye Name: 4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]-2-piperidyl]-2,2-diphenyl-butanenitrile CAS Name: 4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]-2-piperidinyl]-2,2-diphenylbutanenitrile IUPAC Name: 4-[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-2-yl]-2,2-diphenylbutanenitrile Traditional Name: 4-(1-homopiperonyl-2-piperidyl)-2,2-diphenyl-butyronitrile Formula: C30H32N2O2 MolecularWeight: 452.58728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)CCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(C(C1)CCC(C#N)(C2=CC=CC=C2)C3=CC=CC=C3)CCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H32N2O2/c31-22-30(25-9-3-1-4-10-25,26-11-5-2-6-12-26)18-16-27-13-7-8-19-32(27)20-17-24-14-15-28-29(21-24)34-23-33-28/h1-6,9-12,14-15,21,27H,7-8,13,16-20,23H2