9-[2-[(4-nitrophenyl)methoxy]phenyl]-2,6,7-tris(oxidanyl)xanthen-3-one

Systemtic Name: 9-[2-[(4-nitrophenyl)methoxy]phenyl]-2,6,7-tris(oxidanyl)xanthen-3-one Openeye Name: 2,6,7-trihydroxy-9-[2-[(4-nitrophenyl)methoxy]phenyl]xanthen-3-one CAS Name: 2,6,7-trihydroxy-9-[2-[(4-nitrophenyl)methoxy]phenyl]-3-xanthenone IUPAC Name: 2,6,7-trihydroxy-9-[2-[(4-nitrophenyl)methoxy]phenyl]xanthen-3-one Traditional Name: 2,6,7-trihydroxy-9-[2-(4-nitrobenzyl)oxyphenyl]fluorone Formula: C26H17NO8 MolecularWeight: 471.41508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O)OCC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O)OCC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H17NO8/c28-19-9-17-24(11-21(19)30)35-25-12-22(31)20(29)10-18(25)26(17)16-3-1-2-4-23(16)34-13-14-5-7-15(8-6-14)27(32)33/h1-12,28-30H,13H2