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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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