1-[3-(2-chloranyl-7-methyl-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[3-(2-chloranyl-7-methyl-quinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[3-(2-chloro-7-methyl-3-quinolyl)-5-phenyl-3,4-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[3-(2-chloro-7-methyl-3-quinolinyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[3-(2-chloro-7-methylquinolin-3-yl)-5-phenyl-3,4-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[5-(2-chloro-7-methyl-3-quinolyl)-3-phenyl-2-pyrazolin-1-yl]propan-1-one Formula: C22H20ClN3O MolecularWeight: 377.8667

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClN3O/c1-3-21(27)26-20(13-19(25-26)15-7-5-4-6-8-15)17-12-16-10-9-14(2)11-18(16)24-22(17)23/h4-12,20H,3,13H2,1-2H3