2-(4-tert-butylphenyl)-3-[2-cyclohexylethyl(methyl)amino]-2-propan-2-yl-pentanenitrile

Systemtic Name: 2-(4-tert-butylphenyl)-3-[2-cyclohexylethyl(methyl)amino]-2-propan-2-yl-pentanenitrile Openeye Name: 2-(4-tert-butylphenyl)-3-[2-cyclohexylethyl(methyl)amino]-2-isopropyl-pentanenitrile CAS Name: 2-(4-tert-butylphenyl)-3-[2-cyclohexylethyl(methyl)amino]-2-propan-2-ylpentanenitrile IUPAC Name: 2-(4-tert-butylphenyl)-3-[2-cyclohexylethyl(methyl)amino]-2-propan-2-ylpentanenitrile Traditional Name: 2-(4-tert-butylphenyl)-3-[2-cyclohexylethyl(methyl)amino]-2-isopropyl-valeronitrile Formula: C27H44N2 MolecularWeight: 396.65166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C#N)(C1=CC=C(C=C1)C(C)(C)C)C(C)C)N(C)CCC2CCCCC2

Isomeric SMILES

CCC(C(C#N)(C1=CC=C(C=C1)C(C)(C)C)C(C)C)N(C)CCC2CCCCC2

InChI

InChI=1S/C27H44N2/c1-8-25(29(7)19-18-22-12-10-9-11-13-22)27(20-28,21(2)3)24-16-14-23(15-17-24)26(4,5)6/h14-17,21-22,25H,8-13,18-19H2,1-7H3