disodium 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(2-oxidanidyl-2-oxidanylidene-ethoxy)phenyl]-5-methyl-2,3-dihydro-1H-indene-2-carboxylate

Systemtic Name: disodium 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(2-oxidanidyl-2-oxidanylidene-ethoxy)phenyl]-5-methyl-2,3-dihydro-1H-indene-2-carboxylate Openeye Name: disodium 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(2-oxido-2-oxo-ethoxy)phenyl]-5-methyl-indane-2-carboxylate CAS Name: disodium 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(2-oxido-2-oxoethoxy)phenyl]-5-methyl-2,3-dihydro-1H-indene-2-carboxylate IUPAC Name: disodium 1-(1,3-benzodioxol-5-yl)-3-[4-methoxy-2-(2-oxido-2-oxoethoxy)phenyl]-5-methyl-2,3-dihydro-1H-indene-2-carboxylate Traditional Name: disodium 1-(1,3-benzodioxol-5-yl)-3-[2-(2-keto-2-oxido-ethoxy)-4-methoxy-phenyl]-5-methyl-indane-2-carboxylate Formula: C27H22Na2O8 MolecularWeight: 520.43832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)OCC(=O)[O-])C(=O)[O-])C4=CC5=C(C=C4)OCO5.[Na+].[Na+]

Isomeric SMILES

CC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)OCC(=O)[O-])C(=O)[O-])C4=CC5=C(C=C4)OCO5.[Na+].[Na+]

InChI

InChI=1S/C27H24O8.2Na/c1-14-3-6-17-19(9-14)25(18-7-5-16(32-2)11-21(18)33-12-23(28)29)26(27(30)31)24(17)15-4-8-20-22(10-15)35-13-34-20;;/h3-11,24-26H,12-13H2,1-2H3,(H,28,29)(H,30,31);;/q;2*+1/p-2