dimethyl-[2-(7-oxidanylidene-1,4-diazepan-4-ium-1-yl)ethyl]azanium

Systemtic Name: dimethyl-[2-(7-oxidanylidene-1,4-diazepan-4-ium-1-yl)ethyl]azanium Openeye Name: dimethyl-[2-(7-oxo-1,4-diazepan-4-ium-1-yl)ethyl]ammonium CAS Name: dimethyl-[2-(7-oxo-1,4-diazepan-4-ium-1-yl)ethyl]ammonium IUPAC Name: dimethyl-[2-(7-oxo-1,4-diazepan-4-ium-1-yl)ethyl]azanium Traditional Name: 2-(7-keto-1,4-diazepan-4-ium-1-yl)ethyl-dimethyl-ammonium Formula: C9H21N3O+2 MolecularWeight: 187.28254

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1CC[NH2+]CCC1=O

Isomeric SMILES

C[NH+](C)CCN1CC[NH2+]CCC1=O

InChI

InChI=1S/C9H19N3O/c1-11(2)7-8-12-6-5-10-4-3-9(12)13/h10H,3-8H2,1-2H3/p+2