[6-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxidanylidene-hexyl]azanium

Systemtic Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxidanylidene-hexyl]azanium Openeye Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxo-hexyl]ammonium CAS Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxohexyl]ammonium IUPAC Name: [6-(4-methyl-1,4-diazepan-4-ium-1-yl)-6-oxohexyl]azanium Traditional Name: [6-keto-6-(4-methyl-1,4-diazepan-4-ium-1-yl)hexyl]ammonium Formula: C12H27N3O+2 MolecularWeight: 229.36228

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)CCCCC[NH3+]

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)CCCCC[NH3+]

InChI

InChI=1S/C12H25N3O/c1-14-8-5-9-15(11-10-14)12(16)6-3-2-4-7-13/h2-11,13H2,1H3/p+2