3-[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[2-(2-furylmethylamino)-2-oxo-ethyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[2-(2-furanylmethylamino)-2-oxoethyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[2-(furan-2-ylmethylamino)-2-oxoethyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[2-(2-furfurylamino)-2-keto-ethyl]ammonio]propyl-dimethyl-ammonium Formula: C12H23N3O2+2 MolecularWeight: 241.32992

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[NH2+]CC(=O)NCC1=CC=CO1

Isomeric SMILES

C[NH+](C)CCC[NH2+]CC(=O)NCC1=CC=CO1

InChI

InChI=1S/C12H21N3O2/c1-15(2)7-4-6-13-10-12(16)14-9-11-5-3-8-17-11/h3,5,8,13H,4,6-7,9-10H2,1-2H3,(H,14,16)/p+2