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

Systemtic Name: [(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]-(4-methylcyclohexyl)azanium Openeye Name: (4-methylcyclohexyl)-[(1S)-1-methyl-2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxopropan-2-yl]-(4-methylcyclohexyl)ammonium IUPAC Name: [(2S)-1-[[(2S)-butan-2-yl]amino]-1-oxopropan-2-yl]-(4-methylcyclohexyl)azanium Traditional Name: [(1S)-2-keto-1-methyl-2-[[(1S)-1-methylpropyl]amino]ethyl]-(4-methylcyclohexyl)ammonium Formula: C14H29N2O+ MolecularWeight: 241.39286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(C)[NH2+]C1CCC(CC1)C

Isomeric SMILES

CC[C@H](C)NC(=O)[C@H](C)[NH2+]C1CCC(CC1)C

InChI

InChI=1S/C14H28N2O/c1-5-11(3)15-14(17)12(4)16-13-8-6-10(2)7-9-13/h10-13,16H,5-9H2,1-4H3,(H,15,17)/p+1/t10?,11-,12-,13?/m0/s1