methyl 1-[[2,6-bis(iodanyl)-3,4,5-trimethoxy-phenyl]methyl]-2-oxidanylidene-3H-indene-1-carboxylate

Systemtic Name: methyl 1-[[2,6-bis(iodanyl)-3,4,5-trimethoxy-phenyl]methyl]-2-oxidanylidene-3H-indene-1-carboxylate Openeye Name: methyl 1-[(2,6-diiodo-3,4,5-trimethoxy-phenyl)methyl]-2-oxo-indane-1-carboxylate CAS Name: 1-[(2,6-diiodo-3,4,5-trimethoxyphenyl)methyl]-2-oxo-3H-indene-1-carboxylic acid methyl ester IUPAC Name: methyl 1-[(2,6-diiodo-3,4,5-trimethoxyphenyl)methyl]-2-oxo-3H-indene-1-carboxylate Traditional Name: 1-(2,6-diiodo-3,4,5-trimethoxy-benzyl)-2-keto-indane-1-carboxylic acid methyl ester Formula: C21H20I2O6 MolecularWeight: 622.18884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1OC)I)CC2(C(=O)CC3=CC=CC=C32)C(=O)OC)I)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1OC)I)CC2(C(=O)CC3=CC=CC=C32)C(=O)OC)I)OC

InChI

InChI=1S/C21H20I2O6/c1-26-17-15(22)12(16(23)18(27-2)19(17)28-3)10-21(20(25)29-4)13-8-6-5-7-11(13)9-14(21)24/h5-8H,9-10H2,1-4H3