(E)-2-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]carbonyl-3-pyridin-3-yl-prop-2-enenitrile

Systemtic Name: (E)-2-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]carbonyl-3-pyridin-3-yl-prop-2-enenitrile Openeye Name: (E)-2-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carbonyl]-3-(3-pyridyl)prop-2-enenitrile CAS Name: (E)-2-[[1-(2-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-oxomethyl]-3-(3-pyridinyl)-2-propenenitrile IUPAC Name: (E)-2-[1-(2-fluorophenyl)-2,5-dimethylpyrrole-3-carbonyl]-3-pyridin-3-ylprop-2-enenitrile Traditional Name: (E)-2-[1-(2-fluorophenyl)-2,5-dimethyl-pyrrole-3-carbonyl]-3-(3-pyridyl)acrylonitrile Formula: C21H16FN3O MolecularWeight: 345.369643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2F)C)C(=O)C(=CC3=CN=CC=C3)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2F)C)C(=O)/C(=C/C3=CN=CC=C3)/C#N

InChI

InChI=1S/C21H16FN3O/c1-14-10-18(15(2)25(14)20-8-4-3-7-19(20)22)21(26)17(12-23)11-16-6-5-9-24-13-16/h3-11,13H,1-2H3/b17-11+