[(2S)-1-(azepan-1-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-(azepan-1-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-(azepane-1-carbonyl)-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(1-azepanyl)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(azepan-1-yl)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-(azepane-1-carbonyl)-3-methyl-butyl]ammonium Formula: C12H25N2O+ MolecularWeight: 213.3397

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCCCC1)[NH3+]

Isomeric SMILES

CC(C)C[C@@H](C(=O)N1CCCCCC1)[NH3+]

InChI

InChI=1S/C12H24N2O/c1-10(2)9-11(13)12(15)14-7-5-3-4-6-8-14/h10-11H,3-9,13H2,1-2H3/p+1/t11-/m0/s1