[(2S,6S)-2,6-dimethylcyclohexyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]azanium

Systemtic Name: [(2S,6S)-2,6-dimethylcyclohexyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]azanium Openeye Name: [(2S,6S)-2,6-dimethylcyclohexyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]ammonium CAS Name: [(2S,6S)-2,6-dimethylcyclohexyl]-[2-(2-methyl-1-benzimidazolyl)ethyl]ammonium IUPAC Name: [(2S,6S)-2,6-dimethylcyclohexyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]azanium Traditional Name: [(2S,6S)-2,6-dimethylcyclohexyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]ammonium Formula: C18H28N3+ MolecularWeight: 286.43502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1[NH2+]CCN2C(=NC3=CC=CC=C32)C)C

Isomeric SMILES

C[C@H]1CCC[C@@H](C1[NH2+]CCN2C(=NC3=CC=CC=C32)C)C

InChI

InChI=1S/C18H27N3/c1-13-7-6-8-14(2)18(13)19-11-12-21-15(3)20-16-9-4-5-10-17(16)21/h4-5,9-10,13-14,18-19H,6-8,11-12H2,1-3H3/p+1/t13-,14-/m0/s1