2-[4-(4-chlorophenyl)-4-oxidanyl-2-(4-pentanoyloxyphenyl)-5H-1,3-thiazol-5-yl]ethanoic acid

Systemtic Name: 2-[4-(4-chlorophenyl)-4-oxidanyl-2-(4-pentanoyloxyphenyl)-5H-1,3-thiazol-5-yl]ethanoic acid Openeye Name: 2-[4-(4-chlorophenyl)-4-hydroxy-2-(4-pentanoyloxyphenyl)-5H-thiazol-5-yl]acetic acid CAS Name: 2-[4-(4-chlorophenyl)-4-hydroxy-2-[4-(1-oxopentoxy)phenyl]-5H-thiazol-5-yl]acetic acid IUPAC Name: 2-[4-(4-chlorophenyl)-4-hydroxy-2-(4-pentanoyloxyphenyl)-5H-1,3-thiazol-5-yl]acetic acid Traditional Name: 2-[4-(4-chlorophenyl)-4-hydroxy-2-(4-valeryloxyphenyl)-2-thiazolin-5-yl]acetic acid Formula: C22H22ClNO5S MolecularWeight: 447.93178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC=C(C=C1)C2=NC(C(S2)CC(=O)O)(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCCCC(=O)OC1=CC=C(C=C1)C2=NC(C(S2)CC(=O)O)(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C22H22ClNO5S/c1-2-3-4-20(27)29-17-11-5-14(6-12-17)21-24-22(28,18(30-21)13-19(25)26)15-7-9-16(23)10-8-15/h5-12,18,28H,2-4,13H2,1H3,(H,25,26)