2-[[4-[3-[4-[bis(oxidanidyloxymethyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-oxidanidyl-4-oxidanylidene-cyclobuten-1-yl]phenyl]-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate

Systemtic Name: 2-[[4-[3-[4-[bis(oxidanidyloxymethyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-oxidanidyl-4-oxidanylidene-cyclobuten-1-yl]phenyl]-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate Openeye Name: 2-[4-[3-[4-[bis(oxidooxymethyl)iminio]cyclohexa-2,5-dien-1-ylidene]-2-oxido-4-oxo-cyclobuten-1-yl]-N-(2-oxido-2-oxo-ethyl)anilino]acetate CAS Name: 2-[4-[3-[4-[bis(oxidooxymethyl)iminio]-1-cyclohexa-2,5-dienylidene]-2-oxido-4-oxo-1-cyclobutenyl]-N-(2-oxido-2-oxoethyl)anilino]acetate IUPAC Name: 2-[4-[3-[4-[bis(oxidooxymethyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-2-oxido-4-oxocyclobuten-1-yl]-N-(2-oxido-2-oxoethyl)anilino]acetate Traditional Name: 2-[4-[3-[4-[bis(oxidooxymethyl)iminio]cyclohexa-2,5-dien-1-ylidene]-4-keto-2-oxido-cyclobuten-1-yl]-N-(2-keto-2-oxido-ethyl)anilino]acetate Formula: C22H16N2O10-4 MolecularWeight: 468.36984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=[N+](CO[O-])CO[O-])C=CC1=C2C(=C(C2=O)C3=CC=C(C=C3)N(CC(=O)[O-])CC(=O)[O-])[O-]

Isomeric SMILES

C1=CC(=[N+](CO[O-])CO[O-])C=CC1=C2C(=C(C2=O)C3=CC=C(C=C3)N(CC(=O)[O-])CC(=O)[O-])[O-]

InChI

InChI=1S/C22H20N2O10/c25-17(26)9-23(10-18(27)28)15-5-1-13(2-6-15)19-21(29)20(22(19)30)14-3-7-16(8-4-14)24(11-33-31)12-34-32/h1-8H,9-12H2,(H4-,25,26,27,28,29,31,32)/p-4