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

Systemtic Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxy-2-nitro-phenyl)-2-propan-2-yl-pentanenitrile Openeye Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxy-2-nitro-phenyl)-2-isopropyl-pentanenitrile CAS Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxy-2-nitrophenyl)-2-propan-2-ylpentanenitrile IUPAC Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxy-2-nitrophenyl)-2-propan-2-ylpentanenitrile Traditional Name: 3-[2-cyclohexylethyl(methyl)amino]-2-(3,4-dimethoxy-2-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=C(C(=C(C=C1)OC)OC)[N+](=O)[O-])C(C)C)N(C)CCC2CCCCC2

Isomeric SMILES

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

InChI

InChI=1S/C25H39N3O4/c1-7-22(27(4)16-15-19-11-9-8-10-12-19)25(17-26,18(2)3)20-13-14-21(31-5)24(32-6)23(20)28(29)30/h13-14,18-19,22H,7-12,15-16H2,1-6H3