[(1R,2S)-2-methylcyclohexyl]-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: [(1R,2S)-2-methylcyclohexyl]-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: [(1R,2S)-2-methylcyclohexyl]-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: [(1R,2S)-2-methylcyclohexyl]-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: [(1R,2S)-2-methylcyclohexyl]-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: [(1S)-1-(4-mesylphenyl)ethyl]-[(1R,2S)-2-methylcyclohexyl]ammonium Formula: C16H26NO2S+ MolecularWeight: 296.44814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO2S/c1-12-6-4-5-7-16(12)17-13(2)14-8-10-15(11-9-14)20(3,18)19/h8-13,16-17H,4-7H2,1-3H3/p+1/t12-,13-,16+/m0/s1