2-[16-(2-oxidanidyl-2-oxidanylidene-ethyl)-1,4,10,13-tetraoxa-7,16-diazoniacyclooctadec-7-yl]ethanoate

Systemtic Name: 2-[16-(2-oxidanidyl-2-oxidanylidene-ethyl)-1,4,10,13-tetraoxa-7,16-diazoniacyclooctadec-7-yl]ethanoate Openeye Name: 2-[16-(2-oxido-2-oxo-ethyl)-1,4,10,13-tetraoxa-7,16-diazoniacyclooctadec-7-yl]acetate CAS Name: 2-[16-(2-oxido-2-oxoethyl)-1,4,10,13-tetraoxa-7,16-diazoniacyclooctadec-7-yl]acetate IUPAC Name: 2-[16-(2-oxido-2-oxoethyl)-1,4,10,13-tetraoxa-7,16-diazoniacyclooctadec-7-yl]acetate Traditional Name: 2-[16-(2-keto-2-oxido-ethyl)-1,4,10,13-tetraoxa-7,16-diazoniacyclooctadec-7-yl]acetate Formula: C16H30N2O8 MolecularWeight: 378.418

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCC[NH+](CCOCCOCC[NH+]1CC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

C1COCCOCC[NH+](CCOCCOCC[NH+]1CC(=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C16H30N2O8/c19-15(20)13-17-1-5-23-9-10-25-7-3-18(14-16(21)22)4-8-26-12-11-24-6-2-17/h1-14H2,(H,19,20)(H,21,22)