(3-methylphenyl)methyl-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]azanium

Systemtic Name: (3-methylphenyl)methyl-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]azanium Openeye Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-(m-tolylmethyl)ammonium CAS Name: (3-methylphenyl)methyl-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]ammonium IUPAC Name: (3-methylphenyl)methyl-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]azanium Traditional Name: [(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]-(3-methylbenzyl)ammonium Formula: C18H30N+ MolecularWeight: 260.4375

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)[NH2+]CC2=CC=CC(=C2)C)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H29N/c1-13(2)17-9-8-15(4)11-18(17)19-12-16-7-5-6-14(3)10-16/h5-7,10,13,15,17-19H,8-9,11-12H2,1-4H3/p+1/t15-,17+,18-/m0/s1