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

Systemtic Name: [(2S)-butan-2-yl]-[(3S)-2-oxidanylideneazepan-3-yl]azanium Openeye Name: [(1S)-1-methylpropyl]-[(3S)-2-oxoazepan-3-yl]ammonium CAS Name: [(2S)-butan-2-yl]-[(3S)-2-oxo-3-azepanyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(3S)-2-oxoazepan-3-yl]azanium Traditional Name: [(3S)-2-ketoazepan-3-yl]-[(1S)-1-methylpropyl]ammonium Formula: C10H21N2O+ MolecularWeight: 185.28654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]C1CCCCNC1=O

Isomeric SMILES

CC[C@H](C)[NH2+][C@H]1CCCCNC1=O

InChI

InChI=1S/C10H20N2O/c1-3-8(2)12-9-6-4-5-7-11-10(9)13/h8-9,12H,3-7H2,1-2H3,(H,11,13)/p+1/t8-,9-/m0/s1