4-azanyl-3-bromanyl-5-methoxy-benzenesulfonic acid

Systemtic Name: 4-azanyl-3-bromanyl-5-methoxy-benzenesulfonic acid Openeye Name: 4-amino-3-bromo-5-methoxy-benzenesulfonic acid CAS Name: 4-amino-3-bromo-5-methoxybenzenesulfonic acid IUPAC Name: 4-amino-3-bromo-5-methoxybenzenesulfonic acid Traditional Name: 4-amino-3-bromo-5-methoxy-besylic acid Formula: C7H8BrNO4S MolecularWeight: 282.11172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1N)Br)S(=O)(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1N)Br)S(=O)(=O)O

InChI

InChI=1S/C7H8BrNO4S/c1-13-6-3-4(14(10,11)12)2-5(8)7(6)9/h2-3H,9H2,1H3,(H,10,11,12)