3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-diethoxyphenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-diethoxyphenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-diethoxyphenyl)-2-isopropyl-pentanenitrile CAS Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-diethoxyphenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-diethoxyphenyl)-2-propan-2-ylpentanenitrile Traditional Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-diethoxyphenyl)-2-isopropyl-valeronitrile Formula: C27H44N2O2 MolecularWeight: 428.65046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H44N2O2/c1-7-26(29(6)16-15-22-13-11-10-12-14-22)27(20-28,21(4)5)23-17-24(30-8-2)19-25(18-23)31-9-3/h17-19,21-22,26H,7-16H2,1-6H3