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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)[NH2+]C1CCC(CC1)C

Isomeric SMILES

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

InChI

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