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

Systemtic Name: (4-dimethylaminophenyl)methyl-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexyl]ammonium Formula: C19H33N2+ MolecularWeight: 289.47872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32N2/c1-14(2)18-11-6-15(3)12-19(18)20-13-16-7-9-17(10-8-16)21(4)5/h7-10,14-15,18-20H,6,11-13H2,1-5H3/p+1/t15-,18+,19-/m0/s1