2,2-bis(7-nitro-2-oxidanyl-4-oxidanylidene-chromen-3-yl)ethanoic acid

Systemtic Name: 2,2-bis(7-nitro-2-oxidanyl-4-oxidanylidene-chromen-3-yl)ethanoic acid Openeye Name: 2,2-bis(2-hydroxy-7-nitro-4-oxo-chromen-3-yl)acetic acid CAS Name: 2,2-bis(2-hydroxy-7-nitro-4-oxo-1-benzopyran-3-yl)acetic acid IUPAC Name: 2,2-bis(2-hydroxy-7-nitro-4-oxochromen-3-yl)acetic acid Traditional Name: 2,2-bis(2-hydroxy-4-keto-7-nitro-chromen-3-yl)acetic acid Formula: C20H10N2O12 MolecularWeight: 470.2996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])OC(=C(C2=O)C(C3=C(OC4=C(C3=O)C=CC(=C4)[N+](=O)[O-])O)C(=O)O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])OC(=C(C2=O)C(C3=C(OC4=C(C3=O)C=CC(=C4)[N+](=O)[O-])O)C(=O)O)O

InChI

InChI=1S/C20H10N2O12/c23-16-9-3-1-7(21(29)30)5-11(9)33-19(27)14(16)13(18(25)26)15-17(24)10-4-2-8(22(31)32)6-12(10)34-20(15)28/h1-6,13,27-28H,(H,25,26)