3-[3-(carboxymethyl)-4-decoxy-phenyl]carbonylbenzoic acid

Systemtic Name: 3-[3-(carboxymethyl)-4-decoxy-phenyl]carbonylbenzoic acid Openeye Name: 3-[3-(carboxymethyl)-4-decoxy-benzoyl]benzoic acid CAS Name: 3-[[3-(carboxymethyl)-4-decoxyphenyl]-oxomethyl]benzoic acid IUPAC Name: 3-[3-(carboxymethyl)-4-decoxybenzoyl]benzoic acid Traditional Name: 3-[3-(carboxymethyl)-4-decoxy-benzoyl]benzoic acid Formula: C26H32O6 MolecularWeight: 440.52868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)CC(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)CC(=O)O

InChI

InChI=1S/C26H32O6/c1-2-3-4-5-6-7-8-9-15-32-23-14-13-20(17-22(23)18-24(27)28)25(29)19-11-10-12-21(16-19)26(30)31/h10-14,16-17H,2-9,15,18H2,1H3,(H,27,28)(H,30,31)