5-[[4-(5-chloranyl-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]methyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[4-(5-chloranyl-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]methyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[[4-(2-benzyloxy-5-chloro-phenyl)thiazol-2-yl]methyl]-2-hydroxy-benzoic acid CAS Name: 5-[[4-(5-chloro-2-phenylmethoxyphenyl)-2-thiazolyl]methyl]-2-hydroxybenzoic acid IUPAC Name: 5-[[4-(5-chloro-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]methyl]-2-hydroxybenzoic acid Traditional Name: 5-[[4-(2-benzoxy-5-chloro-phenyl)thiazol-2-yl]methyl]-2-hydroxy-benzoic acid Formula: C24H18ClNO4S MolecularWeight: 451.92202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=CSC(=N3)CC4=CC(=C(C=C4)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=CSC(=N3)CC4=CC(=C(C=C4)O)C(=O)O

InChI

InChI=1S/C24H18ClNO4S/c25-17-7-9-22(30-13-15-4-2-1-3-5-15)18(12-17)20-14-31-23(26-20)11-16-6-8-21(27)19(10-16)24(28)29/h1-10,12,14,27H,11,13H2,(H,28,29)