(4-methylcyclohexyl)-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]azanium

Systemtic Name: (4-methylcyclohexyl)-[(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl]azanium Openeye Name: [(1S)-2-(isopropylamino)-1-methyl-2-oxo-ethyl]-(4-methylcyclohexyl)ammonium CAS Name: (4-methylcyclohexyl)-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]ammonium IUPAC Name: (4-methylcyclohexyl)-[(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl]azanium Traditional Name: [(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl]-(4-methylcyclohexyl)ammonium Formula: C13H27N2O+ MolecularWeight: 227.36628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH2+]C(C)C(=O)NC(C)C

Isomeric SMILES

CC1CCC(CC1)[NH2+][C@@H](C)C(=O)NC(C)C

InChI

InChI=1S/C13H26N2O/c1-9(2)14-13(16)11(4)15-12-7-5-10(3)6-8-12/h9-12,15H,5-8H2,1-4H3,(H,14,16)/p+1/t10?,11-,12?/m0/s1