[3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxidanylidene-propyl]azanium Openeye Name: [3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxo-propyl]ammonium CAS Name: [3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxopropyl]ammonium IUPAC Name: [3-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-oxopropyl]azanium Traditional Name: [3-keto-3-(4-methyl-1,4-diazepan-4-ium-1-yl)propyl]ammonium Formula: C9H21N3O+2 MolecularWeight: 187.28254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H19N3O/c1-11-5-2-6-12(8-7-11)9(13)3-4-10/h2-8,10H2,1H3/p+2