[(1R,2S)-2-methylcyclohexyl]-[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: [(1R,2S)-2-methylcyclohexyl]-[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]azanium Openeye Name: [(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]-[(1R,2S)-2-methylcyclohexyl]ammonium CAS Name: [(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]-[(1R,2S)-2-methylcyclohexyl]ammonium IUPAC Name: [(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]-[(1R,2S)-2-methylcyclohexyl]azanium Traditional Name: [(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]-[(1R,2S)-2-methylcyclohexyl]ammonium Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]C(C)C2=C(C=C(C=C2)C)O

Isomeric SMILES

C[C@H]1CCCC[C@H]1[NH2+][C@@H](C)C2=C(C=C(C=C2)C)O

InChI

InChI=1S/C16H25NO/c1-11-8-9-14(16(18)10-11)13(3)17-15-7-5-4-6-12(15)2/h8-10,12-13,15,17-18H,4-7H2,1-3H3/p+1/t12-,13-,15+/m0/s1