3-[3-(2-carboxyethyl)-4-ethoxy-phenyl]carbonylbenzoic acid

Systemtic Name: 3-[3-(2-carboxyethyl)-4-ethoxy-phenyl]carbonylbenzoic acid Openeye Name: 3-[3-(2-carboxyethyl)-4-ethoxy-benzoyl]benzoic acid CAS Name: 3-[[3-(2-carboxyethyl)-4-ethoxyphenyl]-oxomethyl]benzoic acid IUPAC Name: 3-[3-(2-carboxyethyl)-4-ethoxybenzoyl]benzoic acid Traditional Name: 3-[3-(2-carboxyethyl)-4-ethoxy-benzoyl]benzoic acid Formula: C19H18O6 MolecularWeight: 342.34262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)CCC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)CCC(=O)O

InChI

InChI=1S/C19H18O6/c1-2-25-16-8-6-14(10-12(16)7-9-17(20)21)18(22)13-4-3-5-15(11-13)19(23)24/h3-6,8,10-11H,2,7,9H2,1H3,(H,20,21)(H,23,24)