[2,2-dimethyl-3-[[(3S)-2-oxidanylideneazepan-3-yl]azaniumyl]propyl]-dimethyl-azanium

Systemtic Name: [2,2-dimethyl-3-[[(3S)-2-oxidanylideneazepan-3-yl]azaniumyl]propyl]-dimethyl-azanium Openeye Name: [2,2-dimethyl-3-[[(3S)-2-oxoazepan-3-yl]ammonio]propyl]-dimethyl-ammonium CAS Name: [2,2-dimethyl-3-[[(3S)-2-oxo-3-azepanyl]ammonio]propyl]-dimethylammonium IUPAC Name: [2,2-dimethyl-3-[[(3S)-2-oxoazepan-3-yl]azaniumyl]propyl]-dimethylazanium Traditional Name: [3-[[(3S)-2-ketoazepan-3-yl]ammonio]-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C13H29N3O+2 MolecularWeight: 243.38886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]C1CCCCNC1=O)C[NH+](C)C

Isomeric SMILES

CC(C)(C[NH2+][C@H]1CCCCNC1=O)C[NH+](C)C

InChI

InChI=1S/C13H27N3O/c1-13(2,10-16(3)4)9-15-11-7-5-6-8-14-12(11)17/h11,15H,5-10H2,1-4H3,(H,14,17)/p+2/t11-/m0/s1