4-(2-chloranyl-6-fluoranyl-phenyl)-4-[2-ethanoyl-5-(thiophen-3-ylmethoxy)phenoxy]butanoate

Systemtic Name: 4-(2-chloranyl-6-fluoranyl-phenyl)-4-[2-ethanoyl-5-(thiophen-3-ylmethoxy)phenoxy]butanoate Openeye Name: 4-[2-acetyl-5-(3-thienylmethoxy)phenoxy]-4-(2-chloro-6-fluoro-phenyl)butanoate CAS Name: 4-[2-acetyl-5-(3-thiophenylmethoxy)phenoxy]-4-(2-chloro-6-fluorophenyl)butanoate IUPAC Name: 4-[2-acetyl-5-(thiophen-3-ylmethoxy)phenoxy]-4-(2-chloro-6-fluorophenyl)butanoate Traditional Name: 4-[2-acetyl-5-(3-thenyloxy)phenoxy]-4-(2-chloro-6-fluoro-phenyl)butyrate Formula: C23H19ClFO5S- MolecularWeight: 461.910363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCC2=CSC=C2)OC(CCC(=O)[O-])C3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCC2=CSC=C2)OC(CCC(=O)[O-])C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C23H20ClFO5S/c1-14(26)17-6-5-16(29-12-15-9-10-31-13-15)11-21(17)30-20(7-8-22(27)28)23-18(24)3-2-4-19(23)25/h2-6,9-11,13,20H,7-8,12H2,1H3,(H,27,28)/p-1