3,4-bis(ethoxycarbonyl)-5-(phenylcarbonyl)phthalate

Systemtic Name: 3,4-bis(ethoxycarbonyl)-5-(phenylcarbonyl)phthalate Openeye Name: 5-benzoyl-3,4-bis(ethoxycarbonyl)phthalate CAS Name: 5-benzoyl-3,4-bis(ethoxycarbonyl)phthalate IUPAC Name: 5-benzoyl-3,4-bis(ethoxycarbonyl)phthalate Traditional Name: 5-benzoyl-3,4-dicarbethoxy-phthalate Formula: C21H16O9-2 MolecularWeight: 412.34634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1C(=O)C2=CC=CC=C2)C(=O)[O-])C(=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1C(=O)C2=CC=CC=C2)C(=O)[O-])C(=O)[O-])C(=O)OCC

InChI

InChI=1S/C21H18O9/c1-3-29-20(27)15-12(17(22)11-8-6-5-7-9-11)10-13(18(23)24)14(19(25)26)16(15)21(28)30-4-2/h5-10H,3-4H2,1-2H3,(H,23,24)(H,25,26)/p-2