(4-dimethylaminophenyl)methyl-[(1S,3S)-3-methylcyclohexyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[(1S,3S)-3-methylcyclohexyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[(1S,3S)-3-methylcyclohexyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[(1S,3S)-3-methylcyclohexyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[(1S,3S)-3-methylcyclohexyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[(1S,3S)-3-methylcyclohexyl]ammonium Formula: C16H27N2+ MolecularWeight: 247.39898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2/c1-13-5-4-6-15(11-13)17-12-14-7-9-16(10-8-14)18(2)3/h7-10,13,15,17H,4-6,11-12H2,1-3H3/p+1/t13-,15-/m0/s1