2-[(1-methylpyrazol-4-yl)sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(1-methylpyrazol-4-yl)sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[(1-methylpyrazol-4-yl)sulfonylamino]-3-phenyl-propanoic acid CAS Name: 2-[(1-methyl-4-pyrazolyl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-[(1-methylpyrazol-4-yl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-[(1-methylpyrazol-4-yl)sulfonylamino]-3-phenyl-propionic acid Formula: C13H15N3O4S MolecularWeight: 309.3409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CN1C=C(C=N1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H15N3O4S/c1-16-9-11(8-14-16)21(19,20)15-12(13(17)18)7-10-5-3-2-4-6-10/h2-6,8-9,12,15H,7H2,1H3,(H,17,18)