3-[2-[(3-chlorophenyl)methoxy]pyrrolidin-1-yl]-2,2-diphenyl-butanenitrile

Systemtic Name: 3-[2-[(3-chlorophenyl)methoxy]pyrrolidin-1-yl]-2,2-diphenyl-butanenitrile Openeye Name: 3-[2-[(3-chlorophenyl)methoxy]pyrrolidin-1-yl]-2,2-diphenyl-butanenitrile CAS Name: 3-[2-[(3-chlorophenyl)methoxy]-1-pyrrolidinyl]-2,2-diphenylbutanenitrile IUPAC Name: 3-[2-[(3-chlorophenyl)methoxy]pyrrolidin-1-yl]-2,2-diphenylbutanenitrile Traditional Name: 3-[2-(3-chlorobenzyl)oxypyrrolidino]-2,2-diphenyl-butyronitrile Formula: C27H27ClN2O MolecularWeight: 430.96908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)N3CCCC3OCC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)N3CCCC3OCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C27H27ClN2O/c1-21(30-17-9-16-26(30)31-19-22-10-8-15-25(28)18-22)27(20-29,23-11-4-2-5-12-23)24-13-6-3-7-14-24/h2-8,10-15,18,21,26H,9,16-17,19H2,1H3