[(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(4-isopropylphenyl)methyl]ammonium CAS Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-(4-isopropylbenzyl)ammonium Formula: C18H30N+ MolecularWeight: 260.4375

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N/c1-13(2)17-10-8-16(9-11-17)12-19-18-7-5-6-14(3)15(18)4/h8-11,13-15,18-19H,5-7,12H2,1-4H3/p+1/t14-,15-,18-/m0/s1