[(1S,2S,4S)-2-(5,6-dimethylbenzimidazol-1-yl)-4-ethyl-cyclohexyl]azanium

Systemtic Name: [(1S,2S,4S)-2-(5,6-dimethylbenzimidazol-1-yl)-4-ethyl-cyclohexyl]azanium Openeye Name: [(1S,2S,4S)-2-(5,6-dimethylbenzimidazol-1-yl)-4-ethyl-cyclohexyl]ammonium CAS Name: [(1S,2S,4S)-2-(5,6-dimethyl-1-benzimidazolyl)-4-ethylcyclohexyl]ammonium IUPAC Name: [(1S,2S,4S)-2-(5,6-dimethylbenzimidazol-1-yl)-4-ethylcyclohexyl]azanium Traditional Name: [(1S,2S,4S)-2-(5,6-dimethylbenzimidazol-1-yl)-4-ethyl-cyclohexyl]ammonium Formula: C17H26N3+ MolecularWeight: 272.40844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(C(C1)N2C=NC3=C2C=C(C(=C3)C)C)[NH3+]

Isomeric SMILES

CC[C@H]1CC[C@@H]([C@H](C1)N2C=NC3=C2C=C(C(=C3)C)C)[NH3+]

InChI

InChI=1S/C17H25N3/c1-4-13-5-6-14(18)16(9-13)20-10-19-15-7-11(2)12(3)8-17(15)20/h7-8,10,13-14,16H,4-6,9,18H2,1-3H3/p+1/t13-,14-,16-/m0/s1