4-[(1-ethylpyrazol-4-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(1-ethylpyrazol-4-yl)carbonylamino]benzoic acid Openeye Name: 4-[(1-ethylpyrazole-4-carbonyl)amino]benzoic acid CAS Name: 4-[[(1-ethyl-4-pyrazolyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(1-ethylpyrazole-4-carbonyl)amino]benzoic acid Traditional Name: 4-[(1-ethylpyrazole-4-carbonyl)amino]benzoic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCN1C=C(C=N1)C(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H13N3O3/c1-2-16-8-10(7-14-16)12(17)15-11-5-3-9(4-6-11)13(18)19/h3-8H,2H2,1H3,(H,15,17)(H,18,19)