methyl 1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-5-phenylmethoxy-1,2-dihydroindene-2-carboxylate

Systemtic Name: methyl 1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-5-phenylmethoxy-1,2-dihydroindene-2-carboxylate Openeye Name: methyl 1-(1,3-benzodioxol-5-yl)-5-benzyloxy-3-oxo-indane-2-carboxylate CAS Name: 1-(1,3-benzodioxol-5-yl)-3-oxo-5-phenylmethoxy-1,2-dihydroindene-2-carboxylic acid methyl ester IUPAC Name: methyl 1-(1,3-benzodioxol-5-yl)-3-oxo-5-phenylmethoxy-1,2-dihydroindene-2-carboxylate Traditional Name: 1-(1,3-benzodioxol-5-yl)-5-benzoxy-3-keto-indane-2-carboxylic acid methyl ester Formula: C25H20O6 MolecularWeight: 416.4227

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC(=O)C1C(C2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H20O6/c1-28-25(27)23-22(16-7-10-20-21(11-16)31-14-30-20)18-9-8-17(12-19(18)24(23)26)29-13-15-5-3-2-4-6-15/h2-12,22-23H,13-14H2,1H3