3-(2,5-dimethoxyphenyl)-1-[2-(2-fluoranylpyridin-3-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-fluoranylpyridin-3-yl)carbonylpyrazolidin-1-yl]prop-2-en-1-one Openeye Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-fluoropyridine-3-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one CAS Name: 3-(2,5-dimethoxyphenyl)-1-[2-[(2-fluoro-3-pyridinyl)-oxomethyl]-1-pyrazolidinyl]-2-propen-1-one IUPAC Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-fluoropyridine-3-carbonyl)pyrazolidin-1-yl]prop-2-en-1-one Traditional Name: 3-(2,5-dimethoxyphenyl)-1-[2-(2-fluoronicotinoyl)pyrazolidin-1-yl]prop-2-en-1-one Formula: C20H20FN3O4 MolecularWeight: 385.388903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3=C(N=CC=C3)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C=CC(=O)N2CCCN2C(=O)C3=C(N=CC=C3)F

InChI

InChI=1S/C20H20FN3O4/c1-27-15-7-8-17(28-2)14(13-15)6-9-18(25)23-11-4-12-24(23)20(26)16-5-3-10-22-19(16)21/h3,5-10,13H,4,11-12H2,1-2H3