(4-dimethylaminophenyl)methyl-[(1R,2S)-2-methylcyclohexyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[(1R,2S)-2-methylcyclohexyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(1R,2S)-2-methylcyclohexyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(1R,2S)-2-methylcyclohexyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(1R,2S)-2-methylcyclohexyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1R,2S)-2-methylcyclohexyl]ammonium Formula: C16H27N2+ MolecularWeight: 247.39898

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2/c1-13-6-4-5-7-16(13)17-12-14-8-10-15(11-9-14)18(2)3/h8-11,13,16-17H,4-7,12H2,1-3H3/p+1/t13-,16+/m0/s1