6-[(2-butyl-1-benzofuran-3-yl)carbonyl]-2-(carboxymethyloxy)naphthalene-1-carboxylic acid

Systemtic Name: 6-[(2-butyl-1-benzofuran-3-yl)carbonyl]-2-(carboxymethyloxy)naphthalene-1-carboxylic acid Openeye Name: 6-(2-butylbenzofuran-3-carbonyl)-2-(carboxymethyloxy)naphthalene-1-carboxylic acid CAS Name: 6-[(2-butyl-3-benzofuranyl)-oxomethyl]-2-(carboxymethyloxy)-1-naphthalenecarboxylic acid IUPAC Name: 6-(2-butyl-1-benzofuran-3-carbonyl)-2-(carboxymethyloxy)naphthalene-1-carboxylic acid Traditional Name: 6-(2-butylbenzofuran-3-carbonyl)-2-(carboxymethyloxy)-1-naphthoic acid Formula: C26H22O7 MolecularWeight: 446.44868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)C(=O)O

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC4=C(C=C3)C(=C(C=C4)OCC(=O)O)C(=O)O

InChI

InChI=1S/C26H22O7/c1-2-3-7-21-23(18-6-4-5-8-19(18)33-21)25(29)16-9-11-17-15(13-16)10-12-20(24(17)26(30)31)32-14-22(27)28/h4-6,8-13H,2-3,7,14H2,1H3,(H,27,28)(H,30,31)