5-acetamido-2-azanyl-4-bromanyl-benzenesulfonic acid

Systemtic Name: 5-acetamido-2-azanyl-4-bromanyl-benzenesulfonic acid Openeye Name: 5-acetamido-2-amino-4-bromo-benzenesulfonic acid CAS Name: 5-acetamido-2-amino-4-bromobenzenesulfonic acid IUPAC Name: 5-acetamido-2-amino-4-bromobenzenesulfonic acid Traditional Name: 5-acetamido-2-amino-4-bromo-besylic acid Formula: C8H9BrN2O4S MolecularWeight: 309.13706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1Br)N)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1Br)N)S(=O)(=O)O

InChI

InChI=1S/C8H9BrN2O4S/c1-4(12)11-7-3-8(16(13,14)15)6(10)2-5(7)9/h2-3H,10H2,1H3,(H,11,12)(H,13,14,15)