3-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]methoxy]benzoic acid

Systemtic Name: 3-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]methoxy]benzoic acid Openeye Name: 3-[[4-(4-bromophenyl)thiazol-2-yl]methoxy]benzoic acid CAS Name: 3-[[4-(4-bromophenyl)-2-thiazolyl]methoxy]benzoic acid IUPAC Name: 3-[[4-(4-bromophenyl)-1,3-thiazol-2-yl]methoxy]benzoic acid Traditional Name: 3-[[4-(4-bromophenyl)thiazol-2-yl]methoxy]benzoic acid Formula: C17H12BrNO3S MolecularWeight: 390.25108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=NC(=CS2)C3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C17H12BrNO3S/c18-13-6-4-11(5-7-13)15-10-23-16(19-15)9-22-14-3-1-2-12(8-14)17(20)21/h1-8,10H,9H2,(H,20,21)