2-bromanyl-2-[5-(3-chloranyl-4-methoxy-phenyl)-4-(4-sulfamoylphenyl)-1,3-oxazol-2-yl]ethanoic acid

Systemtic Name: 2-bromanyl-2-[5-(3-chloranyl-4-methoxy-phenyl)-4-(4-sulfamoylphenyl)-1,3-oxazol-2-yl]ethanoic acid Openeye Name: 2-bromo-2-[5-(3-chloro-4-methoxy-phenyl)-4-(4-sulfamoylphenyl)oxazol-2-yl]acetic acid CAS Name: 2-bromo-2-[5-(3-chloro-4-methoxyphenyl)-4-(4-sulfamoylphenyl)-2-oxazolyl]acetic acid IUPAC Name: 2-bromo-2-[5-(3-chloro-4-methoxyphenyl)-4-(4-sulfamoylphenyl)-1,3-oxazol-2-yl]acetic acid Traditional Name: 2-bromo-2-[5-(3-chloro-4-methoxy-phenyl)-4-(4-sulfamoylphenyl)oxazol-2-yl]acetic acid Formula: C18H14BrClN2O6S MolecularWeight: 501.73556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(N=C(O2)C(C(=O)O)Br)C3=CC=C(C=C3)S(=O)(=O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(N=C(O2)C(C(=O)O)Br)C3=CC=C(C=C3)S(=O)(=O)N)Cl

InChI

InChI=1S/C18H14BrClN2O6S/c1-27-13-7-4-10(8-12(13)20)16-15(22-17(28-16)14(19)18(23)24)9-2-5-11(6-3-9)29(21,25)26/h2-8,14H,1H3,(H,23,24)(H2,21,25,26)