2-[3-[(4-bromophenyl)methoxy]phenyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[3-[(4-bromophenyl)methoxy]phenyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[3-[(4-bromophenyl)methoxy]phenyl]thiazole-4-carboxylic acid CAS Name: 2-[3-[(4-bromophenyl)methoxy]phenyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[3-[(4-bromophenyl)methoxy]phenyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[3-(4-bromobenzyl)oxyphenyl]thiazole-4-carboxylic acid Formula: C17H12BrNO3S MolecularWeight: 390.25108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=CC=C(C=C2)Br)C3=NC(=CS3)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=CC=C(C=C2)Br)C3=NC(=CS3)C(=O)O

InChI

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