2-[(2-methoxy-5-nitro-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)sulfonylamino]butanoic acid Openeye Name: 2-[(2-methoxy-5-nitro-phenyl)sulfonylamino]butanoic acid CAS Name: 2-[(2-methoxy-5-nitrophenyl)sulfonylamino]butanoic acid IUPAC Name: 2-[(2-methoxy-5-nitrophenyl)sulfonylamino]butanoic acid Traditional Name: 2-[(2-methoxy-5-nitro-phenyl)sulfonylamino]butyric acid Formula: C11H14N2O7S MolecularWeight: 318.30306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O7S/c1-3-8(11(14)15)12-21(18,19)10-6-7(13(16)17)4-5-9(10)20-2/h4-6,8,12H,3H2,1-2H3,(H,14,15)