5-(3-carboxy-5-oxidanyl-phenyl)carbonyloxy-2,4-dimethyl-benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(3-carboxy-5-oxidanyl-phenyl)carbonyloxy-2,4-dimethyl-benzene-1,3-dicarboxylic acid Openeye Name: 5-(3-carboxy-5-hydroxy-benzoyl)oxy-2,4-dimethyl-benzene-1,3-dicarboxylic acid CAS Name: 5-[(3-carboxy-5-hydroxyphenyl)-oxomethoxy]-2,4-dimethylbenzene-1,3-dicarboxylic acid IUPAC Name: 5-(3-carboxy-5-hydroxybenzoyl)oxy-2,4-dimethylbenzene-1,3-dicarboxylic acid Traditional Name: 5-(3-carboxy-5-hydroxy-benzoyl)oxy-2,4-dimethyl-isophthalic acid Formula: C18H14O9 MolecularWeight: 374.29836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(=O)O)OC(=O)C2=CC(=CC(=C2)C(=O)O)O)C)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C=C1C(=O)O)OC(=O)C2=CC(=CC(=C2)C(=O)O)O)C)C(=O)O

InChI

InChI=1S/C18H14O9/c1-7-12(16(22)23)6-13(8(2)14(7)17(24)25)27-18(26)10-3-9(15(20)21)4-11(19)5-10/h3-6,19H,1-2H3,(H,20,21)(H,22,23)(H,24,25)