[4-(4-bromophenyl)phenyl] 3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonate

Systemtic Name: [4-(4-bromophenyl)phenyl] 3-methyl-2-oxidanylidene-1,3-benzoxazole-6-sulfonate Openeye Name: [4-(4-bromophenyl)phenyl] 3-methyl-2-oxo-1,3-benzoxazole-6-sulfonate CAS Name: 3-methyl-2-oxo-1,3-benzoxazole-6-sulfonic acid [4-(4-bromophenyl)phenyl] ester IUPAC Name: [4-(4-bromophenyl)phenyl] 3-methyl-2-oxo-1,3-benzoxazole-6-sulfonate Traditional Name: 2-keto-3-methyl-1,3-benzoxazole-6-sulfonic acid [4-(4-bromophenyl)phenyl] ester Formula: C20H14BrNO5S MolecularWeight: 460.29786

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)Br)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)Br)OC1=O

InChI

InChI=1S/C20H14BrNO5S/c1-22-18-11-10-17(12-19(18)26-20(22)23)28(24,25)27-16-8-4-14(5-9-16)13-2-6-15(21)7-3-13/h2-12H,1H3