[(1S,2S,4R)-4-methyl-2-(4-methylpentoxy)cyclohexyl]azanium

Systemtic Name: [(1S,2S,4R)-4-methyl-2-(4-methylpentoxy)cyclohexyl]azanium Openeye Name: [(1S,2S,4R)-2-isohexyloxy-4-methyl-cyclohexyl]ammonium CAS Name: [(1S,2S,4R)-4-methyl-2-(4-methylpentoxy)cyclohexyl]ammonium IUPAC Name: [(1S,2S,4R)-4-methyl-2-(4-methylpentoxy)cyclohexyl]azanium Traditional Name: [(1S,2S,4R)-2-isohexyloxy-4-methyl-cyclohexyl]ammonium Formula: C13H28NO+ MolecularWeight: 214.36752

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OCCCC(C)C)[NH3+]

Isomeric SMILES

C[C@@H]1CC[C@@H]([C@H](C1)OCCCC(C)C)[NH3+]

InChI

InChI=1S/C13H27NO/c1-10(2)5-4-8-15-13-9-11(3)6-7-12(13)14/h10-13H,4-9,14H2,1-3H3/p+1/t11-,12+,13+/m1/s1