[(2R)-2-(azepan-1-ium-1-yl)-2,4-dimethyl-pentyl]azanium

Systemtic Name: [(2R)-2-(azepan-1-ium-1-yl)-2,4-dimethyl-pentyl]azanium Openeye Name: [(2R)-2-(azepan-1-ium-1-yl)-2,4-dimethyl-pentyl]ammonium CAS Name: [(2R)-2-(1-azepan-1-iumyl)-2,4-dimethylpentyl]ammonium IUPAC Name: [(2R)-2-(azepan-1-ium-1-yl)-2,4-dimethylpentyl]azanium Traditional Name: [(2R)-2-(azepan-1-ium-1-yl)-2,4-dimethyl-pentyl]ammonium Formula: C13H30N2+2 MolecularWeight: 214.3907

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H28N2/c1-12(2)10-13(3,11-14)15-8-6-4-5-7-9-15/h12H,4-11,14H2,1-3H3/p+2/t13-/m1/s1