5-[2-(3-carboxy-4-oxidanyl-phenyl)butan-2-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-(3-carboxy-4-oxidanyl-phenyl)butan-2-yl]-2-oxidanyl-benzoic acid Openeye Name: 5-[1-(3-carboxy-4-hydroxy-phenyl)-1-methyl-propyl]-2-hydroxy-benzoic acid CAS Name: 5-[2-(3-carboxy-4-hydroxyphenyl)butan-2-yl]-2-hydroxybenzoic acid IUPAC Name: 5-[2-(3-carboxy-4-hydroxyphenyl)butan-2-yl]-2-hydroxybenzoic acid Traditional Name: 5-[1-(3-carboxy-4-hydroxy-phenyl)-1-methyl-propyl]-2-hydroxy-benzoic acid Formula: C18H18O6 MolecularWeight: 330.33192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1=CC(=C(C=C1)O)C(=O)O)C2=CC(=C(C=C2)O)C(=O)O

Isomeric SMILES

CCC(C)(C1=CC(=C(C=C1)O)C(=O)O)C2=CC(=C(C=C2)O)C(=O)O

InChI

InChI=1S/C18H18O6/c1-3-18(2,10-4-6-14(19)12(8-10)16(21)22)11-5-7-15(20)13(9-11)17(23)24/h4-9,19-20H,3H2,1-2H3,(H,21,22)(H,23,24)