[(2S)-3-[(1R,2S)-2-ethylcyclohexyl]oxy-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-[(1R,2S)-2-ethylcyclohexyl]oxy-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-[(1R,2S)-2-ethylcyclohexoxy]-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-[(1R,2S)-2-ethylcyclohexyl]oxy-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-[(1R,2S)-2-ethylcyclohexyl]oxy-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-[(1R,2S)-2-ethylcyclohexoxy]-2-hydroxy-propyl]-methyl-ammonium Formula: C12H26NO2+ MolecularWeight: 216.34034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCC1OCC(C[NH2+]C)O

Isomeric SMILES

CC[C@H]1CCCC[C@H]1OC[C@H](C[NH2+]C)O

InChI

InChI=1S/C12H25NO2/c1-3-10-6-4-5-7-12(10)15-9-11(14)8-13-2/h10-14H,3-9H2,1-2H3/p+1/t10-,11-,12+/m0/s1