4-[(2-methyl-5-nitro-phenyl)sulfamoyl]butanoic acid

Systemtic Name: 4-[(2-methyl-5-nitro-phenyl)sulfamoyl]butanoic acid Openeye Name: 4-[(2-methyl-5-nitro-phenyl)sulfamoyl]butanoic acid CAS Name: 4-[(2-methyl-5-nitrophenyl)sulfamoyl]butanoic acid IUPAC Name: 4-[(2-methyl-5-nitrophenyl)sulfamoyl]butanoic acid Traditional Name: 4-[(2-methyl-5-nitro-phenyl)sulfamoyl]butyric acid Formula: C11H14N2O6S MolecularWeight: 302.30366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O6S/c1-8-4-5-9(13(16)17)7-10(8)12-20(18,19)6-2-3-11(14)15/h4-5,7,12H,2-3,6H2,1H3,(H,14,15)