2-[4-(4-methyl-5-oxidanylidene-3-pyridin-3-yl-4H-pyrazol-1-yl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(4-methyl-5-oxidanylidene-3-pyridin-3-yl-4H-pyrazol-1-yl)phenyl]ethanoic acid Openeye Name: 2-[4-[4-methyl-5-oxo-3-(3-pyridyl)-4H-pyrazol-1-yl]phenyl]acetic acid CAS Name: 2-[4-[4-methyl-5-oxo-3-(3-pyridinyl)-4H-pyrazol-1-yl]phenyl]acetic acid IUPAC Name: 2-[4-(4-methyl-5-oxo-3-pyridin-3-yl-4H-pyrazol-1-yl)phenyl]acetic acid Traditional Name: 2-[4-[5-keto-4-methyl-3-(3-pyridyl)-2-pyrazolin-1-yl]phenyl]acetic acid Formula: C17H15N3O3 MolecularWeight: 309.3193

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NN(C1=O)C2=CC=C(C=C2)CC(=O)O)C3=CN=CC=C3

Isomeric SMILES

CC1C(=NN(C1=O)C2=CC=C(C=C2)CC(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C17H15N3O3/c1-11-16(13-3-2-8-18-10-13)19-20(17(11)23)14-6-4-12(5-7-14)9-15(21)22/h2-8,10-11H,9H2,1H3,(H,21,22)