[2-(azepan-1-ium-1-yl)-2-ethyl-butyl]azanium

Systemtic Name: [2-(azepan-1-ium-1-yl)-2-ethyl-butyl]azanium Openeye Name: [2-(azepan-1-ium-1-yl)-2-ethyl-butyl]ammonium CAS Name: [2-(1-azepan-1-iumyl)-2-ethylbutyl]ammonium IUPAC Name: [2-(azepan-1-ium-1-yl)-2-ethylbutyl]azanium Traditional Name: [2-(azepan-1-ium-1-yl)-2-ethyl-butyl]ammonium Formula: C12H28N2+2 MolecularWeight: 200.36412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C[NH3+])[NH+]1CCCCCC1

Isomeric SMILES

CCC(CC)(C[NH3+])[NH+]1CCCCCC1

InChI

InChI=1S/C12H26N2/c1-3-12(4-2,11-13)14-9-7-5-6-8-10-14/h3-11,13H2,1-2H3/p+2