[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-[(2S)-3-methylbutan-2-yl]azanium

Systemtic Name: [(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-[(2S)-3-methylbutan-2-yl]azanium Openeye Name: [(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]-[(1S)-1,2-dimethylpropyl]ammonium CAS Name: [(2R)-1-(1-azepanyl)-1-oxopropan-2-yl]-[(2S)-3-methylbutan-2-yl]ammonium IUPAC Name: [(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl]-[(2S)-3-methylbutan-2-yl]azanium Traditional Name: [(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]-[(1S)-1,2-dimethylpropyl]ammonium Formula: C14H29N2O+ MolecularWeight: 241.39286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(C)C)[NH2+][C@H](C)C(=O)N1CCCCCC1

InChI

InChI=1S/C14H28N2O/c1-11(2)12(3)15-13(4)14(17)16-9-7-5-6-8-10-16/h11-13,15H,5-10H2,1-4H3/p+1/t12-,13+/m0/s1