[(2S)-3,3-dimethyl-1-(2-oxidanylideneazepan-1-yl)butan-2-yl]azanium

Systemtic Name: [(2S)-3,3-dimethyl-1-(2-oxidanylideneazepan-1-yl)butan-2-yl]azanium Openeye Name: [(1S)-2,2-dimethyl-1-[(2-oxoazepan-1-yl)methyl]propyl]ammonium CAS Name: [(2S)-3,3-dimethyl-1-(2-oxo-1-azepanyl)butan-2-yl]ammonium IUPAC Name: [(2S)-3,3-dimethyl-1-(2-oxoazepan-1-yl)butan-2-yl]azanium Traditional Name: [(1S)-1-[(2-ketoazepan-1-yl)methyl]-2,2-dimethyl-propyl]ammonium Formula: C12H25N2O+ MolecularWeight: 213.3397

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1CCCCCC1=O)[NH3+]

Isomeric SMILES

CC(C)(C)[C@@H](CN1CCCCCC1=O)[NH3+]

InChI

InChI=1S/C12H24N2O/c1-12(2,3)10(13)9-14-8-6-4-5-7-11(14)15/h10H,4-9,13H2,1-3H3/p+1/t10-/m1/s1