3-[(2-methyl-6-nitro-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 3-[(2-methyl-6-nitro-phenyl)sulfonylamino]butanoic acid Openeye Name: 3-[(2-methyl-6-nitro-phenyl)sulfonylamino]butanoic acid CAS Name: 3-[(2-methyl-6-nitrophenyl)sulfonylamino]butanoic acid IUPAC Name: 3-[(2-methyl-6-nitrophenyl)sulfonylamino]butanoic acid Traditional Name: 3-[(2-methyl-6-nitro-phenyl)sulfonylamino]butyric acid Formula: C11H14N2O6S MolecularWeight: 302.30366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])S(=O)(=O)NC(C)CC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])S(=O)(=O)NC(C)CC(=O)O

InChI

InChI=1S/C11H14N2O6S/c1-7-4-3-5-9(13(16)17)11(7)20(18,19)12-8(2)6-10(14)15/h3-5,8,12H,6H2,1-2H3,(H,14,15)