3-[(5-nitro-2-oxidanyl-phenyl)-(2-oxidanyl-4-oxidanylidene-4a,8a-dihydrochromen-3-yl)methyl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[(5-nitro-2-oxidanyl-phenyl)-(2-oxidanyl-4-oxidanylidene-4a,8a-dihydrochromen-3-yl)methyl]-2-oxidanyl-chromen-4-one Openeye Name: 2-hydroxy-3-[(2-hydroxy-5-nitro-phenyl)-(2-hydroxy-4-oxo-4a,8a-dihydrochromen-3-yl)methyl]chromen-4-one CAS Name: 2-hydroxy-3-[(2-hydroxy-5-nitrophenyl)-(2-hydroxy-4-oxo-4a,8a-dihydro-1-benzopyran-3-yl)methyl]-1-benzopyran-4-one IUPAC Name: 2-hydroxy-3-[(2-hydroxy-5-nitrophenyl)-(2-hydroxy-4-oxo-4a,8a-dihydrochromen-3-yl)methyl]chromen-4-one Traditional Name: 2-hydroxy-3-[(2-hydroxy-4-keto-4a,8a-dihydrochromen-3-yl)-(2-hydroxy-5-nitro-phenyl)methyl]chromone Formula: C25H17NO9 MolecularWeight: 475.40378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)C(C3=C(C=CC(=C3)[N+](=O)[O-])O)C4=C(OC5C=CC=CC5C4=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(O2)O)C(C3=C(C=CC(=C3)[N+](=O)[O-])O)C4=C(OC5C=CC=CC5C4=O)O

InChI

InChI=1S/C25H17NO9/c27-16-10-9-12(26(32)33)11-15(16)19(20-22(28)13-5-1-3-7-17(13)34-24(20)30)21-23(29)14-6-2-4-8-18(14)35-25(21)31/h1-11,13,17,19,27,30-31H