2-(4-chlorophenyl)-2-cyclobutyl-5-[phenethyl(propyl)amino]pentanenitrile

Systemtic Name: 2-(4-chlorophenyl)-2-cyclobutyl-5-[phenethyl(propyl)amino]pentanenitrile Openeye Name: 2-(4-chlorophenyl)-2-cyclobutyl-5-[phenethyl(propyl)amino]pentanenitrile CAS Name: 2-(4-chlorophenyl)-2-cyclobutyl-5-[phenethyl(propyl)amino]pentanenitrile IUPAC Name: 2-(4-chlorophenyl)-2-cyclobutyl-5-[phenethyl(propyl)amino]pentanenitrile Traditional Name: 2-(4-chlorophenyl)-2-cyclobutyl-5-[phenethyl(propyl)amino]valeronitrile Formula: C26H33ClN2 MolecularWeight: 409.00662

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C#N)(C1CCC1)C2=CC=C(C=C2)Cl)CCC3=CC=CC=C3

Isomeric SMILES

CCCN(CCCC(C#N)(C1CCC1)C2=CC=C(C=C2)Cl)CCC3=CC=CC=C3

InChI

InChI=1S/C26H33ClN2/c1-2-18-29(20-16-22-8-4-3-5-9-22)19-7-17-26(21-28,23-10-6-11-23)24-12-14-25(27)15-13-24/h3-5,8-9,12-15,23H,2,6-7,10-11,16-20H2,1H3