2-[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(3-bromanyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(3-bromo-4-methoxyphenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(3-bromo-4-methoxyphenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(3-bromo-4-methoxy-phenyl)thiazol-2-yl]acetic acid Formula: C12H10BrNO3S MolecularWeight: 328.1817

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)CC(=O)O)Br

InChI

InChI=1S/C12H10BrNO3S/c1-17-10-3-2-7(4-8(10)13)9-6-18-11(14-9)5-12(15)16/h2-4,6H,5H2,1H3,(H,15,16)