2-[[3-(2-carboxyethyl)-4-decoxy-phenyl]methyl]-6-ethoxy-benzoic acid

Systemtic Name: 2-[[3-(2-carboxyethyl)-4-decoxy-phenyl]methyl]-6-ethoxy-benzoic acid Openeye Name: 2-[[3-(2-carboxyethyl)-4-decoxy-phenyl]methyl]-6-ethoxy-benzoic acid CAS Name: 2-[[3-(2-carboxyethyl)-4-decoxyphenyl]methyl]-6-ethoxybenzoic acid IUPAC Name: 2-[[3-(2-carboxyethyl)-4-decoxyphenyl]methyl]-6-ethoxybenzoic acid Traditional Name: 2-[3-(2-carboxyethyl)-4-decoxy-benzyl]-6-ethoxy-benzoic acid Formula: C29H40O6 MolecularWeight: 484.6243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)CC2=C(C(=CC=C2)OCC)C(=O)O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)CC2=C(C(=CC=C2)OCC)C(=O)O)CCC(=O)O

InChI

InChI=1S/C29H40O6/c1-3-5-6-7-8-9-10-11-19-35-25-17-15-22(20-23(25)16-18-27(30)31)21-24-13-12-14-26(34-4-2)28(24)29(32)33/h12-15,17,20H,3-11,16,18-19,21H2,1-2H3,(H,30,31)(H,32,33)