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

Systemtic Name: [2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]-(4-methylcyclohexyl)azanium Openeye Name: (4-methylcyclohexyl)-[2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl]ammonium CAS Name: [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]-(4-methylcyclohexyl)ammonium IUPAC Name: [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]-(4-methylcyclohexyl)azanium Traditional Name: [2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl]-(4-methylcyclohexyl)ammonium Formula: C13H27N2O+ MolecularWeight: 227.36628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26N2O/c1-4-11(3)15-13(16)9-14-12-7-5-10(2)6-8-12/h10-12,14H,4-9H2,1-3H3,(H,15,16)/p+1/t10?,11-,12?/m0/s1