methyl 3-azanyl-5-methylsulfonyl-2-oxidanyl-benzoate

Systemtic Name: methyl 3-azanyl-5-methylsulfonyl-2-oxidanyl-benzoate Openeye Name: methyl 3-amino-2-hydroxy-5-methylsulfonyl-benzoate CAS Name: 3-amino-2-hydroxy-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-amino-2-hydroxy-5-methylsulfonylbenzoate Traditional Name: 3-amino-2-hydroxy-5-mesyl-benzoic acid methyl ester Formula: C9H11NO5S MolecularWeight: 245.25234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1O)N)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1O)N)S(=O)(=O)C

InChI

InChI=1S/C9H11NO5S/c1-15-9(12)6-3-5(16(2,13)14)4-7(10)8(6)11/h3-4,11H,10H2,1-2H3