3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]propanoic acid

Systemtic Name: 3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]propanoic acid Openeye Name: 3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]propanoic acid CAS Name: 3-[(2-methoxy-5-nitrophenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[(2-methoxy-5-nitrophenyl)sulfonylamino]propanoic acid Traditional Name: 3-[(2-methoxy-5-nitro-phenyl)sulfonylamino]propionic acid Formula: C10H12N2O7S MolecularWeight: 304.27648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC(=O)O

InChI

InChI=1S/C10H12N2O7S/c1-19-8-3-2-7(12(15)16)6-9(8)20(17,18)11-5-4-10(13)14/h2-3,6,11H,4-5H2,1H3,(H,13,14)