[(2S)-1-(butylamino)-1-oxidanylidene-propan-2-yl]-[(1S,2S)-2-methylcyclohexyl]azanium

Systemtic Name: [(2S)-1-(butylamino)-1-oxidanylidene-propan-2-yl]-[(1S,2S)-2-methylcyclohexyl]azanium Openeye Name: [(1S)-2-(butylamino)-1-methyl-2-oxo-ethyl]-[(1S,2S)-2-methylcyclohexyl]ammonium CAS Name: [(2S)-1-(butylamino)-1-oxopropan-2-yl]-[(1S,2S)-2-methylcyclohexyl]ammonium IUPAC Name: [(2S)-1-(butylamino)-1-oxopropan-2-yl]-[(1S,2S)-2-methylcyclohexyl]azanium Traditional Name: [(1S)-2-(butylamino)-2-keto-1-methyl-ethyl]-[(1S,2S)-2-methylcyclohexyl]ammonium Formula: C14H29N2O+ MolecularWeight: 241.39286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)[NH2+]C1CCCCC1C

Isomeric SMILES

CCCCNC(=O)[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C

InChI

InChI=1S/C14H28N2O/c1-4-5-10-15-14(17)12(3)16-13-9-7-6-8-11(13)2/h11-13,16H,4-10H2,1-3H3,(H,15,17)/p+1/t11-,12-,13-/m0/s1