2-[2,6-bis(chloranyl)phenyl]-2-cyclohexyl-5-[(phenylmethyl)-propyl-amino]pentanenitrile

Systemtic Name: 2-[2,6-bis(chloranyl)phenyl]-2-cyclohexyl-5-[(phenylmethyl)-propyl-amino]pentanenitrile Openeye Name: 5-[benzyl(propyl)amino]-2-cyclohexyl-2-(2,6-dichlorophenyl)pentanenitrile CAS Name: 2-cyclohexyl-2-(2,6-dichlorophenyl)-5-[(phenylmethyl)-propylamino]pentanenitrile IUPAC Name: 5-[benzyl(propyl)amino]-2-cyclohexyl-2-(2,6-dichlorophenyl)pentanenitrile Traditional Name: 5-[benzyl(propyl)amino]-2-cyclohexyl-2-(2,6-dichlorophenyl)valeronitrile Formula: C27H34Cl2N2 MolecularWeight: 457.47826

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C#N)(C1CCCCC1)C2=C(C=CC=C2Cl)Cl)CC3=CC=CC=C3

Isomeric SMILES

CCCN(CCCC(C#N)(C1CCCCC1)C2=C(C=CC=C2Cl)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C27H34Cl2N2/c1-2-18-31(20-22-11-5-3-6-12-22)19-10-17-27(21-30,23-13-7-4-8-14-23)26-24(28)15-9-16-25(26)29/h3,5-6,9,11-12,15-16,23H,2,4,7-8,10,13-14,17-20H2,1H3