3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-dimethoxy-4-nitro-phenyl)-2-propan-2-yl-pentanenitrile

Systemtic Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-dimethoxy-4-nitro-phenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-dimethoxy-4-nitro-phenyl)-2-isopropyl-pentanenitrile CAS Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-dimethoxy-4-nitrophenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-dimethoxy-4-nitrophenyl)-2-propan-2-ylpentanenitrile Traditional Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,5-dimethoxy-4-nitro-phenyl)-2-isopropyl-valeronitrile Formula: C25H39N3O4 MolecularWeight: 445.59486

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C#N)(C1=CC(=C(C(=C1)OC)[N+](=O)[O-])OC)C(C)C)N(C)CCC2CCCCC2

Isomeric SMILES

CCC(C(C#N)(C1=CC(=C(C(=C1)OC)[N+](=O)[O-])OC)C(C)C)N(C)CCC2CCCCC2

InChI

InChI=1S/C25H39N3O4/c1-7-23(27(4)14-13-19-11-9-8-10-12-19)25(17-26,18(2)3)20-15-21(31-5)24(28(29)30)22(16-20)32-6/h15-16,18-19,23H,7-14H2,1-6H3