4-[(5-methyl-1,2-oxazol-3-yl)azanidylsulfonyl]-1H-pyrrole-2-carboxylate

Systemtic Name: 4-[(5-methyl-1,2-oxazol-3-yl)azanidylsulfonyl]-1H-pyrrole-2-carboxylate Openeye Name: 4-(5-methylisoxazol-3-yl)azanidylsulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(5-methyl-3-isoxazolyl)azanidylsulfonyl]-1H-pyrrole-2-carboxylate IUPAC Name: 4-[(5-methyl-1,2-oxazol-3-yl)azanidylsulfonyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-(5-methylisoxazol-3-yl)azanidylsulfonyl-1H-pyrrole-2-carboxylate Formula: C9H7N3O5S-2 MolecularWeight: 269.23398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)[N-]S(=O)(=O)C2=CNC(=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)[N-]S(=O)(=O)C2=CNC(=C2)C(=O)[O-]

InChI

InChI=1S/C9H9N3O5S/c1-5-2-8(11-17-5)12-18(15,16)6-3-7(9(13)14)10-4-6/h2-4,10H,1H3,(H2,11,12,13,14)/p-2