4-[4-carboxylato-2-(2-methyl-3-oxidanidyl-3-oxidanylidene-propyl)phenyl]phthalate

Systemtic Name: 4-[4-carboxylato-2-(2-methyl-3-oxidanidyl-3-oxidanylidene-propyl)phenyl]phthalate Openeye Name: 4-[4-carboxylato-2-(2-methyl-3-oxido-3-oxo-propyl)phenyl]phthalate CAS Name: 4-[4-carboxylato-2-(2-methyl-3-oxido-3-oxopropyl)phenyl]phthalate IUPAC Name: 4-[4-carboxylato-2-(2-methyl-3-oxido-3-oxopropyl)phenyl]phthalate Traditional Name: 4-[4-carboxylato-2-(3-keto-2-methyl-3-oxido-propyl)phenyl]phthalate Formula: C19H12O8-4 MolecularWeight: 368.29378

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C=CC(=C1)C(=O)[O-])C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(CC1=C(C=CC(=C1)C(=O)[O-])C2=CC(=C(C=C2)C(=O)[O-])C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C19H16O8/c1-9(16(20)21)6-12-7-11(17(22)23)3-4-13(12)10-2-5-14(18(24)25)15(8-10)19(26)27/h2-5,7-9H,6H2,1H3,(H,20,21)(H,22,23)(H,24,25)(H,26,27)/p-4