[2,4-bis(bromanyl)phenyl] 3-acetamido-4-methoxy-benzenesulfonate

Systemtic Name: [2,4-bis(bromanyl)phenyl] 3-acetamido-4-methoxy-benzenesulfonate Openeye Name: (2,4-dibromophenyl) 3-acetamido-4-methoxy-benzenesulfonate CAS Name: 3-acetamido-4-methoxybenzenesulfonic acid (2,4-dibromophenyl) ester IUPAC Name: (2,4-dibromophenyl) 3-acetamido-4-methoxybenzenesulfonate Traditional Name: 3-acetamido-4-methoxy-benzenesulfonic acid (2,4-dibromophenyl) ester Formula: C15H13Br2NO5S MolecularWeight: 479.14042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)Br)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)Br)OC

InChI

InChI=1S/C15H13Br2NO5S/c1-9(19)18-13-8-11(4-6-15(13)22-2)24(20,21)23-14-5-3-10(16)7-12(14)17/h3-8H,1-2H3,(H,18,19)