1-[3-(2-chloranyl-6-methyl-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[3-(2-chloranyl-6-methyl-quinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[3-(2-chloro-6-methyl-3-quinolyl)-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[3-(2-chloro-6-methyl-3-quinolinyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[3-(2-chloro-6-methylquinolin-3-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[5-(2-chloro-6-methyl-3-quinolyl)-3-(p-tolyl)-2-pyrazolin-1-yl]propan-1-one Formula: C23H22ClN3O MolecularWeight: 391.89328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22ClN3O/c1-4-22(28)27-21(13-20(26-27)16-8-5-14(2)6-9-16)18-12-17-11-15(3)7-10-19(17)25-23(18)24/h5-12,21H,4,13H2,1-3H3