[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(2-methylbutan-2-yl)azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(2-methylbutan-2-yl)azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-(1,1-dimethylpropyl)ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-(2-methylbutan-2-yl)ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-[2-(azepan-1-yl)-2-keto-ethyl]ammonium Formula: C13H27N2O+ MolecularWeight: 227.36628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[NH2+]CC(=O)N1CCCCCC1

Isomeric SMILES

CCC(C)(C)[NH2+]CC(=O)N1CCCCCC1

InChI

InChI=1S/C13H26N2O/c1-4-13(2,3)14-11-12(16)15-9-7-5-6-8-10-15/h14H,4-11H2,1-3H3/p+1