2-cyclopentyl-2-(3,4-dichlorophenyl)-5-[(phenylmethyl)-propyl-amino]pentanenitrile

Systemtic Name: 2-cyclopentyl-2-(3,4-dichlorophenyl)-5-[(phenylmethyl)-propyl-amino]pentanenitrile Openeye Name: 5-[benzyl(propyl)amino]-2-cyclopentyl-2-(3,4-dichlorophenyl)pentanenitrile CAS Name: 2-cyclopentyl-2-(3,4-dichlorophenyl)-5-[(phenylmethyl)-propylamino]pentanenitrile IUPAC Name: 5-[benzyl(propyl)amino]-2-cyclopentyl-2-(3,4-dichlorophenyl)pentanenitrile Traditional Name: 5-[benzyl(propyl)amino]-2-cyclopentyl-2-(3,4-dichlorophenyl)valeronitrile Formula: C26H32Cl2N2 MolecularWeight: 443.45168

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCC(C#N)(C1CCCC1)C2=CC(=C(C=C2)Cl)Cl)CC3=CC=CC=C3

Isomeric SMILES

CCCN(CCCC(C#N)(C1CCCC1)C2=CC(=C(C=C2)Cl)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C26H32Cl2N2/c1-2-16-30(19-21-9-4-3-5-10-21)17-8-15-26(20-29,22-11-6-7-12-22)23-13-14-24(27)25(28)18-23/h3-5,9-10,13-14,18,22H,2,6-8,11-12,15-17,19H2,1H3