methyl 5-nitro-2-(sulfamoylmethyl)benzoate

Systemtic Name: methyl 5-nitro-2-(sulfamoylmethyl)benzoate Openeye Name: methyl 5-nitro-2-(sulfamoylmethyl)benzoate CAS Name: 5-nitro-2-(sulfamoylmethyl)benzoic acid methyl ester IUPAC Name: methyl 5-nitro-2-(sulfamoylmethyl)benzoate Traditional Name: 5-nitro-2-(sulfamoylmethyl)benzoic acid methyl ester Formula: C9H10N2O6S MolecularWeight: 274.2505

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CS(=O)(=O)N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])CS(=O)(=O)N

InChI

InChI=1S/C9H10N2O6S/c1-17-9(12)8-4-7(11(13)14)3-2-6(8)5-18(10,15)16/h2-4H,5H2,1H3,(H2,10,15,16)