2-(5-bromanylpyridin-3-yl)-1-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(5-bromanylpyridin-3-yl)-1-[2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(5-bromo-3-pyridyl)-1-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]ethanone CAS Name: 2-(5-bromo-3-pyridinyl)-1-[2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(5-bromopyridin-3-yl)-1-[2-(3-chloro-2,6-dimethoxybenzoyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(5-bromo-3-pyridyl)-1-[2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidin-1-yl]ethanone Formula: C19H19BrClN3O4 MolecularWeight: 468.72886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CC3=CC(=CN=C3)Br

Isomeric SMILES

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=O)CC3=CC(=CN=C3)Br

InChI

InChI=1S/C19H19BrClN3O4/c1-27-15-5-4-14(21)18(28-2)17(15)19(26)24-7-3-6-23(24)16(25)9-12-8-13(20)11-22-10-12/h4-5,8,10-11H,3,6-7,9H2,1-2H3