4-[(2-methyl-3-nitro-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(2-methyl-3-nitro-phenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(2-methyl-3-nitro-phenyl)sulfonylamino]butanoic acid CAS Name: 4-[(2-methyl-3-nitrophenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(2-methyl-3-nitrophenyl)sulfonylamino]butanoic acid Traditional Name: 4-[(2-methyl-3-nitro-phenyl)sulfonylamino]butyric acid Formula: C11H14N2O6S MolecularWeight: 302.30366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1S(=O)(=O)NCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1S(=O)(=O)NCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O6S/c1-8-9(13(16)17)4-2-5-10(8)20(18,19)12-7-3-6-11(14)15/h2,4-5,12H,3,6-7H2,1H3,(H,14,15)