2-[2-(2-methylphenyl)ethyl]-3-oxidanylidene-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid

Systemtic Name: 2-[2-(2-methylphenyl)ethyl]-3-oxidanylidene-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid Openeye Name: 2-[2-(o-tolyl)ethyl]-3-oxo-2-[3-(3-thienylmethoxy)phenoxy]butanoic acid CAS Name: 2-[2-(2-methylphenyl)ethyl]-3-oxo-2-[3-(3-thiophenylmethoxy)phenoxy]butanoic acid IUPAC Name: 2-[2-(2-methylphenyl)ethyl]-3-oxo-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid Traditional Name: 3-keto-2-[2-(o-tolyl)ethyl]-2-[3-(3-thenyloxy)phenoxy]butyric acid Formula: C24H24O5S MolecularWeight: 424.50936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(C(=O)C)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

Isomeric SMILES

CC1=CC=CC=C1CCC(C(=O)C)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

InChI

InChI=1S/C24H24O5S/c1-17-6-3-4-7-20(17)10-12-24(18(2)25,23(26)27)29-22-9-5-8-21(14-22)28-15-19-11-13-30-16-19/h3-9,11,13-14,16H,10,12,15H2,1-2H3,(H,26,27)