2-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[2-(azepan-1-yl)-2-oxo-ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[2-(azepan-1-yl)-2-oxoethyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]amino]ethyl-dimethyl-ammonium Formula: C12H26N3O+ MolecularWeight: 228.35434

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNCC(=O)N1CCCCCC1

Isomeric SMILES

C[NH+](C)CCNCC(=O)N1CCCCCC1

InChI

InChI=1S/C12H25N3O/c1-14(2)10-7-13-11-12(16)15-8-5-3-4-6-9-15/h13H,3-11H2,1-2H3/p+1