4-(1,3-benzodioxol-5-ylmethyl)-3-(2,1,3-benzoxadiazol-5-yl)-5-(4-methoxyphenyl)-5-oxidanyl-furan-2-one

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2,1,3-benzoxadiazol-5-yl)-5-(4-methoxyphenyl)-5-oxidanyl-furan-2-one Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2,1,3-benzoxadiazol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)furan-2-one CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2,1,3-benzoxadiazol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-2-furanone IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2,1,3-benzoxadiazol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)furan-2-one Traditional Name: 3-benzofurazan-5-yl-5-hydroxy-5-(4-methoxyphenyl)-4-piperonyl-furan-2-one Formula: C25H18N2O7 MolecularWeight: 458.41962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NON=C4C=C3)CC5=CC6=C(C=C5)OCO6)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(C(=C(C(=O)O2)C3=CC4=NON=C4C=C3)CC5=CC6=C(C=C5)OCO6)O

InChI

InChI=1S/C25H18N2O7/c1-30-17-6-4-16(5-7-17)25(29)18(10-14-2-9-21-22(11-14)32-13-31-21)23(24(28)33-25)15-3-8-19-20(12-15)27-34-26-19/h2-9,11-12,29H,10,13H2,1H3