methyl 2-[bis(2-hydroxyethyl)sulfamoyl]-6-nitro-benzoate

Systemtic Name: methyl 2-[bis(2-hydroxyethyl)sulfamoyl]-6-nitro-benzoate Openeye Name: methyl 2-[bis(2-hydroxyethyl)sulfamoyl]-6-nitro-benzoate CAS Name: 2-[bis(2-hydroxyethyl)sulfamoyl]-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[bis(2-hydroxyethyl)sulfamoyl]-6-nitrobenzoate Traditional Name: 2-[bis(2-hydroxyethyl)sulfamoyl]-6-nitro-benzoic acid methyl ester Formula: C12H16N2O8S MolecularWeight: 348.32904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1S(=O)(=O)N(CCO)CCO)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CC=C1S(=O)(=O)N(CCO)CCO)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O8S/c1-22-12(17)11-9(14(18)19)3-2-4-10(11)23(20,21)13(5-7-15)6-8-16/h2-4,15-16H,5-8H2,1H3