1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(trifluoromethylsulfonyloxy)phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylate

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(trifluoromethylsulfonyloxy)phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylate Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(trifluoromethylsulfonyloxy)phenyl]-5-propoxy-indane-2-carboxylate CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(trifluoromethylsulfonyloxy)phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylate IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(trifluoromethylsulfonyloxy)phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylate Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(4-methoxy-2-triflyloxy-phenyl)-5-propoxy-indane-2-carboxylate Formula: C28H24F3O9S- MolecularWeight: 593.54497

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)OS(=O)(=O)C(F)(F)F)C(=O)[O-])C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)OS(=O)(=O)C(F)(F)F)C(=O)[O-])C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H25F3O9S/c1-3-10-37-17-6-7-18-20(12-17)25(19-8-5-16(36-2)13-22(19)40-41(34,35)28(29,30)31)26(27(32)33)24(18)15-4-9-21-23(11-15)39-14-38-21/h4-9,11-13,24-26H,3,10,14H2,1-2H3,(H,32,33)/p-1