4-methyl-3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]benzoic acid

Systemtic Name: 4-methyl-3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]benzoic acid Openeye Name: 4-methyl-3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]benzoic acid CAS Name: 4-methyl-3-[(1,3,5-trimethyl-4-pyrazolyl)sulfonylamino]benzoic acid IUPAC Name: 4-methyl-3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]benzoic acid Traditional Name: 4-methyl-3-[(1,3,5-trimethylpyrazol-4-yl)sulfonylamino]benzoic acid Formula: C14H17N3O4S MolecularWeight: 323.36748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=C(N(N=C2C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NS(=O)(=O)C2=C(N(N=C2C)C)C

InChI

InChI=1S/C14H17N3O4S/c1-8-5-6-11(14(18)19)7-12(8)16-22(20,21)13-9(2)15-17(4)10(13)3/h5-7,16H,1-4H3,(H,18,19)