1-[(3S)-3-(2-chloranyl-6-methoxy-quinolin-3-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one

Systemtic Name: 1-[(3S)-3-(2-chloranyl-6-methoxy-quinolin-3-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[(3S)-3-(2-chloro-6-methoxy-3-quinolyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[(3S)-3-(2-chloro-6-methoxy-3-quinolinyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[(3S)-3-(2-chloro-6-methoxyquinolin-3-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[(5S)-5-(2-chloro-6-methoxy-3-quinolyl)-3-(4-methoxyphenyl)-2-pyrazolin-1-yl]propan-1-one Formula: C23H22ClN3O3 MolecularWeight: 423.89208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22ClN3O3/c1-4-22(28)27-21(13-20(26-27)14-5-7-16(29-2)8-6-14)18-12-15-11-17(30-3)9-10-19(15)25-23(18)24/h5-12,21H,4,13H2,1-3H3/t21-/m0/s1