1-[5-(4-bromophenyl)-3-(2-chloranyl-7-methoxy-quinolin-3-yl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[5-(4-bromophenyl)-3-(2-chloranyl-7-methoxy-quinolin-3-yl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[5-(4-bromophenyl)-3-(2-chloro-7-methoxy-3-quinolyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[5-(4-bromophenyl)-3-(2-chloro-7-methoxy-3-quinolinyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[5-(4-bromophenyl)-3-(2-chloro-7-methoxyquinolin-3-yl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[3-(4-bromophenyl)-5-(2-chloro-7-methoxy-3-quinolyl)-2-pyrazolin-1-yl]ethanone Formula: C21H17BrClN3O2 MolecularWeight: 458.73558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Br)C3=C(N=C4C=C(C=CC4=C3)OC)Cl

Isomeric SMILES

CC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Br)C3=C(N=C4C=C(C=CC4=C3)OC)Cl

InChI

InChI=1S/C21H17BrClN3O2/c1-12(27)26-20(11-19(25-26)13-3-6-15(22)7-4-13)17-9-14-5-8-16(28-2)10-18(14)24-21(17)23/h3-10,20H,11H2,1-2H3