methyl 2-nitro-6-(3-oxidanylpropylsulfamoyl)benzoate

Systemtic Name: methyl 2-nitro-6-(3-oxidanylpropylsulfamoyl)benzoate Openeye Name: methyl 2-(3-hydroxypropylsulfamoyl)-6-nitro-benzoate CAS Name: 2-(3-hydroxypropylsulfamoyl)-6-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-(3-hydroxypropylsulfamoyl)-6-nitrobenzoate Traditional Name: 2-(3-hydroxypropylsulfamoyl)-6-nitro-benzoic acid methyl ester Formula: C11H14N2O7S MolecularWeight: 318.30306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O7S/c1-20-11(15)10-8(13(16)17)4-2-5-9(10)21(18,19)12-6-3-7-14/h2,4-5,12,14H,3,6-7H2,1H3