[(1R,2S)-2-(5,6-dimethylbenzimidazol-1-yl)cyclooctyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)C3CCCCCCC3[NH3+]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)[C@H]3CCCCCC[C@H]3[NH3+]

InChI

InChI=1S/C17H25N3/c1-12-9-15-17(10-13(12)2)20(11-19-15)16-8-6-4-3-5-7-14(16)18/h9-11,14,16H,3-8,18H2,1-2H3/p+1/t14-,16+/m1/s1