3'-[(2-nitrophenyl)methoxy]-6'-oxidanyl-spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 3'-[(2-nitrophenyl)methoxy]-6'-oxidanyl-spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 3'-hydroxy-6'-[(2-nitrophenyl)methoxy]spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 3'-hydroxy-6'-[(2-nitrophenyl)methoxy]-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 3'-hydroxy-6'-[(2-nitrophenyl)methoxy]spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 3'-hydroxy-6'-(2-nitrobenzyl)oxy-spiro[phthalan-3,9'-xanthene]-1-one Formula: C27H17NO7 MolecularWeight: 467.42638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC3=C(C=C2)C4(C5=C(O3)C=C(C=C5)O)C6=CC=CC=C6C(=O)O4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC3=C(C=C2)C4(C5=C(O3)C=C(C=C5)O)C6=CC=CC=C6C(=O)O4)[N+](=O)[O-]

InChI

InChI=1S/C27H17NO7/c29-17-9-11-21-24(13-17)34-25-14-18(33-15-16-5-1-4-8-23(16)28(31)32)10-12-22(25)27(21)20-7-3-2-6-19(20)26(30)35-27/h1-14,29H,15H2