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

Systemtic Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(3-methoxyphenyl)methyl]azanium Openeye Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(3-methoxyphenyl)methyl]ammonium CAS Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(3-methoxyphenyl)methyl]ammonium IUPAC Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(3-methoxyphenyl)methyl]azanium Traditional Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-m-anisyl-ammonium Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)[NH2+]CC2=CC(=CC=C2)OC

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@H]1C)[NH2+]CC2=CC(=CC=C2)OC

InChI

InChI=1S/C16H25NO/c1-12-6-4-9-16(13(12)2)17-11-14-7-5-8-15(10-14)18-3/h5,7-8,10,12-13,16-17H,4,6,9,11H2,1-3H3/p+1/t12-,13-,16-/m0/s1