(3-methylphenyl)methyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium

Systemtic Name: (3-methylphenyl)methyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium Openeye Name: m-tolylmethyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium CAS Name: (3-methylphenyl)methyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium IUPAC Name: (3-methylphenyl)methyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium Traditional Name: (3-methylbenzyl)-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium Formula: C17H28N+ MolecularWeight: 246.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)[NH2+]CC2=CC=CC(=C2)C

Isomeric SMILES

C[C@H]1C[C@@H](CC(C1)(C)C)[NH2+]CC2=CC=CC(=C2)C

InChI

InChI=1S/C17H27N/c1-13-6-5-7-15(8-13)12-18-16-9-14(2)10-17(3,4)11-16/h5-8,14,16,18H,9-12H2,1-4H3/p+1/t14-,16-/m0/s1