[(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-methylphenyl)methyl]azanium

Systemtic Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-methylphenyl)methyl]azanium Openeye Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-(o-tolylmethyl)ammonium CAS Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-methylphenyl)methyl]ammonium IUPAC Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-[(2-methylphenyl)methyl]azanium Traditional Name: [(1S,2R,3S)-2,3-dimethylcyclohexyl]-(2-methylbenzyl)ammonium Formula: C16H26N+ MolecularWeight: 232.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]CC2=CC=CC=C2C

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)[NH2+]CC2=CC=CC=C2C

InChI

InChI=1S/C16H25N/c1-12-8-6-10-16(14(12)3)17-11-15-9-5-4-7-13(15)2/h4-5,7,9,12,14,16-17H,6,8,10-11H2,1-3H3/p+1/t12-,14+,16-/m0/s1