3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(furan-2-yl)propanoic acid

Systemtic Name: 3-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(furan-2-yl)propanoic acid Openeye Name: 3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(2-furyl)propanoic acid CAS Name: 3-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonylamino]-3-(2-furanyl)propanoic acid IUPAC Name: 3-[(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylamino]-3-(furan-2-yl)propanoic acid Traditional Name: 3-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonylamino]-3-(2-furyl)propionic acid Formula: C12H14ClN3O5S MolecularWeight: 347.77466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NC(CC(=O)O)C2=CC=CO2)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NC(CC(=O)O)C2=CC=CO2)Cl)C

InChI

InChI=1S/C12H14ClN3O5S/c1-7-11(12(13)16(2)14-7)22(19,20)15-8(6-10(17)18)9-4-3-5-21-9/h3-5,8,15H,6H2,1-2H3,(H,17,18)