2-(4-sulfophenyl)-3,4-dihydropyrazole-5-carboxylic acid

Systemtic Name: 2-(4-sulfophenyl)-3,4-dihydropyrazole-5-carboxylic acid Openeye Name: 2-(4-sulfophenyl)-3,4-dihydropyrazole-5-carboxylic acid CAS Name: 2-(4-sulfophenyl)-3,4-dihydropyrazole-5-carboxylic acid IUPAC Name: 2-(4-sulfophenyl)-3,4-dihydropyrazole-5-carboxylic acid Traditional Name: 1-(4-sulfophenyl)-2-pyrazoline-3-carboxylic acid Formula: C10H10N2O5S MolecularWeight: 270.2618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C(=O)O)C2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

C1CN(N=C1C(=O)O)C2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C10H10N2O5S/c13-10(14)9-5-6-12(11-9)7-1-3-8(4-2-7)18(15,16)17/h1-4H,5-6H2,(H,13,14)(H,15,16,17)