3-[5-ethyl-2,4-bis(oxidanyl)phenyl]carbonylbenzoic acid

Systemtic Name: 3-[5-ethyl-2,4-bis(oxidanyl)phenyl]carbonylbenzoic acid Openeye Name: 3-(5-ethyl-2,4-dihydroxy-benzoyl)benzoic acid CAS Name: 3-[(5-ethyl-2,4-dihydroxyphenyl)-oxomethyl]benzoic acid IUPAC Name: 3-(5-ethyl-2,4-dihydroxybenzoyl)benzoic acid Traditional Name: 3-(5-ethyl-2,4-dihydroxy-benzoyl)benzoic acid Formula: C16H14O5 MolecularWeight: 286.27936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)C2=CC(=CC=C2)C(=O)O)O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)C2=CC(=CC=C2)C(=O)O)O)O

InChI

InChI=1S/C16H14O5/c1-2-9-7-12(14(18)8-13(9)17)15(19)10-4-3-5-11(6-10)16(20)21/h3-8,17-18H,2H2,1H3,(H,20,21)