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

Systemtic Name: methyl (1S,2R)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-5-propoxy-1,2-dihydroindene-2-carboxylate Openeye Name: methyl (1S,2R)-1-(1,3-benzodioxol-5-yl)-3-oxo-5-propoxy-indane-2-carboxylate CAS Name: (1S,2R)-1-(1,3-benzodioxol-5-yl)-3-oxo-5-propoxy-1,2-dihydroindene-2-carboxylic acid methyl ester IUPAC Name: methyl (1S,2R)-1-(1,3-benzodioxol-5-yl)-3-oxo-5-propoxy-1,2-dihydroindene-2-carboxylate Traditional Name: (1S,2R)-1-(1,3-benzodioxol-5-yl)-3-keto-5-propoxy-indane-2-carboxylic acid methyl ester Formula: C21H20O6 MolecularWeight: 368.3799

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCOC1=CC2=C(C=C1)[C@@H]([C@H](C2=O)C(=O)OC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20O6/c1-3-8-25-13-5-6-14-15(10-13)20(22)19(21(23)24-2)18(14)12-4-7-16-17(9-12)27-11-26-16/h4-7,9-10,18-19H,3,8,11H2,1-2H3/t18-,19+/m0/s1