3-azanyl-4-methylsulfonyl-benzoic acid

Systemtic Name: 3-azanyl-4-methylsulfonyl-benzoic acid Openeye Name: 3-amino-4-methylsulfonyl-benzoic acid CAS Name: 3-amino-4-methylsulfonylbenzoic acid IUPAC Name: 3-amino-4-methylsulfonylbenzoic acid Traditional Name: 3-amino-4-mesyl-benzoic acid Formula: C8H9NO4S MolecularWeight: 215.22636

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)N

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)N

InChI

InChI=1S/C8H9NO4S/c1-14(12,13)7-3-2-5(8(10)11)4-6(7)9/h2-4H,9H2,1H3,(H,10,11)