6-methyl-2-(4-methylphenyl)-3-pyrazol-1-yl-quinoline-4-carboxylate

Systemtic Name: 6-methyl-2-(4-methylphenyl)-3-pyrazol-1-yl-quinoline-4-carboxylate Openeye Name: 6-methyl-2-(p-tolyl)-3-pyrazol-1-yl-quinoline-4-carboxylate CAS Name: 6-methyl-2-(4-methylphenyl)-3-(1-pyrazolyl)-4-quinolinecarboxylate IUPAC Name: 6-methyl-2-(4-methylphenyl)-3-pyrazol-1-ylquinoline-4-carboxylate Traditional Name: 6-methyl-2-(p-tolyl)-3-pyrazol-1-yl-cinchoninate Formula: C21H16N3O2- MolecularWeight: 342.37064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)C)C(=O)[O-])N4C=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)C)C(=O)[O-])N4C=CC=N4

InChI

InChI=1S/C21H17N3O2/c1-13-4-7-15(8-5-13)19-20(24-11-3-10-22-24)18(21(25)26)16-12-14(2)6-9-17(16)23-19/h3-12H,1-2H3,(H,25,26)/p-1