3-[(6-nitro-1,3-benzodioxol-5-yl)-(2-oxidanidyl-4-oxidanylidene-chromen-3-yl)methyl]-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)-(2-oxidanidyl-4-oxidanylidene-chromen-3-yl)methyl]-4-oxidanylidene-chromen-2-olate Openeye Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)-(2-oxido-4-oxo-chromen-3-yl)methyl]-4-oxo-chromen-2-olate CAS Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)-(2-oxido-4-oxo-1-benzopyran-3-yl)methyl]-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[(6-nitro-1,3-benzodioxol-5-yl)-(2-oxido-4-oxochromen-3-yl)methyl]-4-oxochromen-2-olate Traditional Name: 4-keto-3-[(4-keto-2-oxido-chromen-3-yl)-(6-nitro-1,3-benzodioxol-5-yl)methyl]chromen-2-olate Formula: C26H13NO10-2 MolecularWeight: 499.38212

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(C3=C(OC4=CC=CC=C4C3=O)[O-])C5=C(OC6=CC=CC=C6C5=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C(C3=C(OC4=CC=CC=C4C3=O)[O-])C5=C(OC6=CC=CC=C6C5=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H15NO10/c28-23-12-5-1-3-7-16(12)36-25(30)21(23)20(14-9-18-19(35-11-34-18)10-15(14)27(32)33)22-24(29)13-6-2-4-8-17(13)37-26(22)31/h1-10,20,30-31H,11H2/p-2