3-[(2-methyl-5-nitro-phenyl)sulfamoyl]propanoic acid

Systemtic Name: 3-[(2-methyl-5-nitro-phenyl)sulfamoyl]propanoic acid Openeye Name: 3-[(2-methyl-5-nitro-phenyl)sulfamoyl]propanoic acid CAS Name: 3-[(2-methyl-5-nitrophenyl)sulfamoyl]propanoic acid IUPAC Name: 3-[(2-methyl-5-nitrophenyl)sulfamoyl]propanoic acid Traditional Name: 3-[(2-methyl-5-nitro-phenyl)sulfamoyl]propionic acid Formula: C10H12N2O6S MolecularWeight: 288.27708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)CCC(=O)O

InChI

InChI=1S/C10H12N2O6S/c1-7-2-3-8(12(15)16)6-9(7)11-19(17,18)5-4-10(13)14/h2-3,6,11H,4-5H2,1H3,(H,13,14)