5-[(3-carboxy-5-methyl-4-oxidanyl-phenyl)-(4-carboxyphenyl)methyl]-3-methyl-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(3-carboxy-5-methyl-4-oxidanyl-phenyl)-(4-carboxyphenyl)methyl]-3-methyl-2-oxidanyl-benzoic acid Openeye Name: 5-[(3-carboxy-4-hydroxy-5-methyl-phenyl)-(4-carboxyphenyl)methyl]-2-hydroxy-3-methyl-benzoic acid CAS Name: 5-[(3-carboxy-4-hydroxy-5-methylphenyl)-(4-carboxyphenyl)methyl]-2-hydroxy-3-methylbenzoic acid IUPAC Name: 5-[(3-carboxy-4-hydroxy-5-methylphenyl)-(4-carboxyphenyl)methyl]-2-hydroxy-3-methylbenzoic acid Traditional Name: 5-[(3-carboxy-4-hydroxy-5-methyl-phenyl)-(4-carboxyphenyl)methyl]-2-hydroxy-3-methyl-benzoic acid Formula: C24H20O8 MolecularWeight: 436.4108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C2=CC=C(C=C2)C(=O)O)C3=CC(=C(C(=C3)C(=O)O)O)C)C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C2=CC=C(C=C2)C(=O)O)C3=CC(=C(C(=C3)C(=O)O)O)C)C(=O)O)O

InChI

InChI=1S/C24H20O8/c1-11-7-15(9-17(20(11)25)23(29)30)19(13-3-5-14(6-4-13)22(27)28)16-8-12(2)21(26)18(10-16)24(31)32/h3-10,19,25-26H,1-2H3,(H,27,28)(H,29,30)(H,31,32)