[(2S)-heptan-2-yl]-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [(2S)-heptan-2-yl]-(4-oxidanylcyclohexyl)azanium Openeye Name: (4-hydroxycyclohexyl)-[(1S)-1-methylhexyl]ammonium CAS Name: [(2S)-heptan-2-yl]-(4-hydroxycyclohexyl)ammonium IUPAC Name: [(2S)-heptan-2-yl]-(4-hydroxycyclohexyl)azanium Traditional Name: (4-hydroxycyclohexyl)-[(1S)-1-methylhexyl]ammonium Formula: C13H28NO+ MolecularWeight: 214.36752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]C1CCC(CC1)O

Isomeric SMILES

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

InChI

InChI=1S/C13H27NO/c1-3-4-5-6-11(2)14-12-7-9-13(15)10-8-12/h11-15H,3-10H2,1-2H3/p+1/t11-,12?,13?/m0/s1