N4-(cyclohexylmethyl)-N4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]cyclohexane-1,4-diamine

Systemtic Name: N4-(cyclohexylmethyl)-N4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]cyclohexane-1,4-diamine Openeye Name: N4-(cyclohexylmethyl)-N4-[(4,5-dimethoxy-2-nitro-phenyl)methyl]cyclohexane-1,4-diamine CAS Name: N4-(cyclohexylmethyl)-N4-[(4,5-dimethoxy-2-nitrophenyl)methyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-(cyclohexylmethyl)-4-N-[(4,5-dimethoxy-2-nitrophenyl)methyl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-(cyclohexylmethyl)-(4,5-dimethoxy-2-nitro-benzyl)amine Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN(CC2CCCCC2)C3CCC(CC3)N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN(CC2CCCCC2)C3CCC(CC3)N)[N+](=O)[O-])OC

InChI

InChI=1S/C22H35N3O4/c1-28-21-12-17(20(25(26)27)13-22(21)29-2)15-24(14-16-6-4-3-5-7-16)19-10-8-18(23)9-11-19/h12-13,16,18-19H,3-11,14-15,23H2,1-2H3