1-(5-fluoranylpyridin-3-yl)oxy-3,3-dimethyl-1-pyrrol-1-yl-butan-2-one

Systemtic Name: 1-(5-fluoranylpyridin-3-yl)oxy-3,3-dimethyl-1-pyrrol-1-yl-butan-2-one Openeye Name: 1-[(5-fluoro-3-pyridyl)oxy]-3,3-dimethyl-1-pyrrol-1-yl-butan-2-one CAS Name: 1-[(5-fluoro-3-pyridinyl)oxy]-3,3-dimethyl-1-(1-pyrrolyl)-2-butanone IUPAC Name: 1-(5-fluoropyridin-3-yl)oxy-3,3-dimethyl-1-pyrrol-1-ylbutan-2-one Traditional Name: 1-[(5-fluoro-3-pyridyl)oxy]-3,3-dimethyl-1-pyrrol-1-yl-butan-2-one Formula: C15H17FN2O2 MolecularWeight: 276.306083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(N1C=CC=C1)OC2=CC(=CN=C2)F

Isomeric SMILES

CC(C)(C)C(=O)C(N1C=CC=C1)OC2=CC(=CN=C2)F

InChI

InChI=1S/C15H17FN2O2/c1-15(2,3)13(19)14(18-6-4-5-7-18)20-12-8-11(16)9-17-10-12/h4-10,14H,1-3H3