(2-acetamidophenyl) 5-bromanyl-2-methyl-benzenesulfonate

Systemtic Name: (2-acetamidophenyl) 5-bromanyl-2-methyl-benzenesulfonate Openeye Name: (2-acetamidophenyl) 5-bromo-2-methyl-benzenesulfonate CAS Name: 5-bromo-2-methylbenzenesulfonic acid (2-acetamidophenyl) ester IUPAC Name: (2-acetamidophenyl) 5-bromo-2-methylbenzenesulfonate Traditional Name: 5-bromo-2-methyl-benzenesulfonic acid (2-acetamidophenyl) ester Formula: C15H14BrNO4S MolecularWeight: 384.24496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)OC2=CC=CC=C2NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)OC2=CC=CC=C2NC(=O)C

InChI

InChI=1S/C15H14BrNO4S/c1-10-7-8-12(16)9-15(10)22(19,20)21-14-6-4-3-5-13(14)17-11(2)18/h3-9H,1-2H3,(H,17,18)