2-[3-[dimethyl-(3-oxidanylidene-3-pentadecoxy-propyl)azaniumyl]propyl-methyl-(2-oxidanidylethyl)azaniumyl]ethanolate

Systemtic Name: 2-[3-[dimethyl-(3-oxidanylidene-3-pentadecoxy-propyl)azaniumyl]propyl-methyl-(2-oxidanidylethyl)azaniumyl]ethanolate Openeye Name: 2-[3-[dimethyl-(3-oxo-3-pentadecoxy-propyl)ammonio]propyl-methyl-(2-oxidoethyl)ammonio]ethanolate CAS Name: 2-[3-[dimethyl-(3-oxo-3-pentadecoxypropyl)ammonio]propyl-methyl-(2-oxidoethyl)ammonio]ethanolate IUPAC Name: 2-[3-[dimethyl-(3-oxo-3-pentadecoxypropyl)azaniumyl]propyl-methyl-(2-oxidoethyl)azaniumyl]ethanolate Traditional Name: 2-[3-[(3-keto-3-pentadecoxy-propyl)-dimethyl-ammonio]propyl-methyl-(2-oxidoethyl)ammonio]ethanolate Formula: C28H58N2O4 MolecularWeight: 486.77112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC(=O)CC[N+](C)(C)CCC[N+](C)(CC[O-])CC[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCOC(=O)CC[N+](C)(C)CCC[N+](C)(CC[O-])CC[O-]

InChI

InChI=1S/C28H58N2O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-27-34-28(33)19-22-29(2,3)20-18-21-30(4,23-25-31)24-26-32/h5-27H2,1-4H3