N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]-4-[(4-nitrocyclohexyl)diazenyl]cyclohexan-1-amine chloride

Systemtic Name: N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]-4-[(4-nitrocyclohexyl)diazenyl]cyclohexan-1-amine chloride Openeye Name: N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]-4-(4-nitrocyclohexyl)azo-cyclohexanamine chloride CAS Name: N-[2-(1-methyl-4-pyridin-1-iumyl)ethyl]-4-(4-nitrocyclohexyl)azo-1-cyclohexanamine chloride IUPAC Name: N-[2-(1-methylpyridin-1-ium-4-yl)ethyl]-4-[(4-nitrocyclohexyl)diazenyl]cyclohexan-1-amine chloride Traditional Name: 2-(1-methylpyridin-1-ium-4-yl)ethyl-[4-(4-nitrocyclohexyl)azocyclohexyl]amine chloride Formula: C20H32ClN5O2 MolecularWeight: 409.95338

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)CCNC2CCC(CC2)N=NC3CCC(CC3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)CCNC2CCC(CC2)N=NC3CCC(CC3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C20H32N5O2.ClH/c1-24-14-11-16(12-15-24)10-13-21-17-2-4-18(5-3-17)22-23-19-6-8-20(9-7-19)25(26)27;/h11-12,14-15,17-21H,2-10,13H2,1H3;1H/q+1;/p-1