(4-dimethylaminophenyl)methyl-[(2S,6S)-2,6-dimethylcyclohexyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[(2S,6S)-2,6-dimethylcyclohexyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(2S,6S)-2,6-dimethylcyclohexyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(2S,6S)-2,6-dimethylcyclohexyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(2S,6S)-2,6-dimethylcyclohexyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(2S,6S)-2,6-dimethylcyclohexyl]ammonium Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1[NH2+]CC2=CC=C(C=C2)N(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2/c1-13-6-5-7-14(2)17(13)18-12-15-8-10-16(11-9-15)19(3)4/h8-11,13-14,17-18H,5-7,12H2,1-4H3/p+1/t13-,14-/m0/s1