[(1S,2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclooctyl]azanium

Systemtic Name: [(1S,2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclooctyl]azanium Openeye Name: [(1S,2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclooctyl]ammonium CAS Name: [(1S,2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclooctyl]ammonium IUPAC Name: [(1S,2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclooctyl]azanium Traditional Name: [(1S,2R)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)cyclooctyl]ammonium Formula: C14H31N3+2 MolecularWeight: 241.41604

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2CCCCCCC2[NH3+]

Isomeric SMILES

C[NH+]1CCCN(CC1)[C@@H]2CCCCCC[C@@H]2[NH3+]

InChI

InChI=1S/C14H29N3/c1-16-9-6-10-17(12-11-16)14-8-5-3-2-4-7-13(14)15/h13-14H,2-12,15H2,1H3/p+2/t13-,14+/m0/s1