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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-5-propoxy-1,2-dihydroindene-2-carboxylate Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-oxo-5-propoxy-indane-2-carboxylate CAS Name: 1-(1,3-benzodioxol-5-yl)-3-oxo-5-propoxy-1,2-dihydroindene-2-carboxylate IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-oxo-5-propoxy-1,2-dihydroindene-2-carboxylate Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-keto-5-propoxy-indane-2-carboxylate Formula: C20H17O6- MolecularWeight: 353.34538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2=O)C(=O)[O-])C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2=O)C(=O)[O-])C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18O6/c1-2-7-24-12-4-5-13-14(9-12)19(21)18(20(22)23)17(13)11-3-6-15-16(8-11)26-10-25-15/h3-6,8-9,17-18H,2,7,10H2,1H3,(H,22,23)/p-1