4-chloranyl-5-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidino]-2-phenyl-pyridazin-3-one Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2CCCN2C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C22H22ClN3O3/c1-28-16-10-11-17(20(13-16)29-2)18-9-6-12-25(18)19-14-24-26(22(27)21(19)23)15-7-4-3-5-8-15/h3-5,7-8,10-11,13-14,18H,6,9,12H2,1-2H3/t18-/m1/s1