2-[7-(4-hexylphenyl)carbonyl-2,3-dihydro-1-benzofuran-5-yl]ethanoic acid

Systemtic Name: 2-[7-(4-hexylphenyl)carbonyl-2,3-dihydro-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[7-(4-hexylbenzoyl)-2,3-dihydrobenzofuran-5-yl]acetic acid CAS Name: 2-[7-[(4-hexylphenyl)-oxomethyl]-2,3-dihydrobenzofuran-5-yl]acetic acid IUPAC Name: 2-[7-(4-hexylbenzoyl)-2,3-dihydro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[7-(4-hexylbenzoyl)coumaran-5-yl]acetic acid Formula: C23H26O4 MolecularWeight: 366.45014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)C2=CC(=CC3=C2OCC3)CC(=O)O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)C2=CC(=CC3=C2OCC3)CC(=O)O

InChI

InChI=1S/C23H26O4/c1-2-3-4-5-6-16-7-9-18(10-8-16)22(26)20-14-17(15-21(24)25)13-19-11-12-27-23(19)20/h7-10,13-14H,2-6,11-12,15H2,1H3,(H,24,25)