5-bromanyl-2-[2-(2-methoxyphenyl)-5-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(2-methoxyphenyl)-5-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]benzoic acid Openeye Name: 5-bromo-2-[2-(2-methoxyphenyl)-5-methyl-4-oxo-thiazolidin-3-yl]benzoic acid CAS Name: 5-bromo-2-[2-(2-methoxyphenyl)-5-methyl-4-oxo-3-thiazolidinyl]benzoic acid IUPAC Name: 5-bromo-2-[2-(2-methoxyphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]benzoic acid Traditional Name: 5-bromo-2-[4-keto-2-(2-methoxyphenyl)-5-methyl-thiazolidin-3-yl]benzoic acid Formula: C18H16BrNO4S MolecularWeight: 422.29294

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC=CC=C2OC)C3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

CC1C(=O)N(C(S1)C2=CC=CC=C2OC)C3=C(C=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C18H16BrNO4S/c1-10-16(21)20(14-8-7-11(19)9-13(14)18(22)23)17(25-10)12-5-3-4-6-15(12)24-2/h3-10,17H,1-2H3,(H,22,23)