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

Systemtic Name: 1-[(3R)-3-(2-chloranyl-7-methoxy-quinolin-3-yl)-5-(3-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3R)-3-(2-chloro-7-methoxy-3-quinolyl)-5-(3-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3R)-3-(2-chloro-7-methoxy-3-quinolinyl)-5-(3-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3R)-3-(2-chloro-7-methoxyquinolin-3-yl)-5-(3-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5R)-5-(2-chloro-7-methoxy-3-quinolyl)-3-(3-methoxyphenyl)-2-pyrazolin-1-yl]ethanone Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)N1[C@H](CC(=N1)C2=CC(=CC=C2)OC)C3=C(N=C4C=C(C=CC4=C3)OC)Cl

InChI

InChI=1S/C22H20ClN3O3/c1-13(27)26-21(12-20(25-26)14-5-4-6-16(9-14)28-2)18-10-15-7-8-17(29-3)11-19(15)24-22(18)23/h4-11,21H,12H2,1-3H3/t21-/m1/s1