5-[bis(phenylmethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)pentanenitrile

Systemtic Name: 5-[bis(phenylmethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)pentanenitrile Openeye Name: 2-cyclobutyl-5-(dibenzylamino)-2-(4-fluorophenyl)pentanenitrile CAS Name: 5-[bis(phenylmethyl)amino]-2-cyclobutyl-2-(4-fluorophenyl)pentanenitrile IUPAC Name: 2-cyclobutyl-5-(dibenzylamino)-2-(4-fluorophenyl)pentanenitrile Traditional Name: 2-cyclobutyl-5-(dibenzylamino)-2-(4-fluorophenyl)valeronitrile Formula: C29H31FN2 MolecularWeight: 426.568243

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(CCCN(CC2=CC=CC=C2)CC3=CC=CC=C3)(C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC(C1)C(CCCN(CC2=CC=CC=C2)CC3=CC=CC=C3)(C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C29H31FN2/c30-28-17-15-27(16-18-28)29(23-31,26-13-7-14-26)19-8-20-32(21-24-9-3-1-4-10-24)22-25-11-5-2-6-12-25/h1-6,9-12,15-18,26H,7-8,13-14,19-22H2