[(1S,2S)-2-azaniumylcycloheptyl]-butyl-methyl-azanium

Systemtic Name: [(1S,2S)-2-azaniumylcycloheptyl]-butyl-methyl-azanium Openeye Name: [(1S,2S)-2-azaniumylcycloheptyl]-butyl-methyl-ammonium CAS Name: [(1S,2S)-2-ammoniocycloheptyl]-butyl-methylammonium IUPAC Name: [(1S,2S)-2-azaniumylcycloheptyl]-butyl-methylazanium Traditional Name: [(1S,2S)-2-ammoniocycloheptyl]-butyl-methyl-ammonium Formula: C12H28N2+2 MolecularWeight: 200.36412

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C1CCCCCC1[NH3+]

Isomeric SMILES

CCCC[NH+](C)[C@H]1CCCCC[C@@H]1[NH3+]

InChI

InChI=1S/C12H26N2/c1-3-4-10-14(2)12-9-7-5-6-8-11(12)13/h11-12H,3-10,13H2,1-2H3/p+2/t11-,12-/m0/s1