2-butyl-3-[4-(2-chloroethyloxymethyl)phenyl]carbonyl-1-benzofuran-5-carboxylic acid

Systemtic Name: 2-butyl-3-[4-(2-chloroethyloxymethyl)phenyl]carbonyl-1-benzofuran-5-carboxylic acid Openeye Name: 2-butyl-3-[4-(2-chloroethoxymethyl)benzoyl]benzofuran-5-carboxylic acid CAS Name: 2-butyl-3-[[4-(2-chloroethoxymethyl)phenyl]-oxomethyl]-5-benzofurancarboxylic acid IUPAC Name: 2-butyl-3-[4-(2-chloroethoxymethyl)benzoyl]-1-benzofuran-5-carboxylic acid Traditional Name: 2-butyl-3-[4-(2-chloroethoxymethyl)benzoyl]benzofuran-5-carboxylic acid Formula: C23H23ClO5 MolecularWeight: 414.87872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)O)C(=O)C3=CC=C(C=C3)COCCCl

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)O)C(=O)C3=CC=C(C=C3)COCCCl

InChI

InChI=1S/C23H23ClO5/c1-2-3-4-20-21(18-13-17(23(26)27)9-10-19(18)29-20)22(25)16-7-5-15(6-8-16)14-28-12-11-24/h5-10,13H,2-4,11-12,14H2,1H3,(H,26,27)