2-(5-bromanylpyridin-3-yl)-1-[2-[1-(4-methoxyphenyl)cyclopropyl]carbonylpyrazolidin-1-yl]ethanone

Systemtic Name: 2-(5-bromanylpyridin-3-yl)-1-[2-[1-(4-methoxyphenyl)cyclopropyl]carbonylpyrazolidin-1-yl]ethanone Openeye Name: 2-(5-bromo-3-pyridyl)-1-[2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]pyrazolidin-1-yl]ethanone CAS Name: 2-(5-bromo-3-pyridinyl)-1-[2-[[1-(4-methoxyphenyl)cyclopropyl]-oxomethyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-(5-bromopyridin-3-yl)-1-[2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]pyrazolidin-1-yl]ethanone Traditional Name: 2-(5-bromo-3-pyridyl)-1-[2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]pyrazolidin-1-yl]ethanone Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC2)C(=O)N3CCCN3C(=O)CC4=CC(=CN=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC2)C(=O)N3CCCN3C(=O)CC4=CC(=CN=C4)Br

InChI

InChI=1S/C21H22BrN3O3/c1-28-18-5-3-16(4-6-18)21(7-8-21)20(27)25-10-2-9-24(25)19(26)12-15-11-17(22)14-23-13-15/h3-6,11,13-14H,2,7-10,12H2,1H3