(E)-2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-3-(4-fluorophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-3-(4-fluorophenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)-3-(4-fluorophenyl)prop-2-enenitrile CAS Name: (E)-2-[(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-oxomethyl]-3-(4-fluorophenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)-3-(4-fluorophenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-acetyl-3,5-dimethyl-1H-pyrrole-2-carbonyl)-3-(4-fluorophenyl)acrylonitrile Formula: C18H15FN2O2 MolecularWeight: 310.322303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C(=CC2=CC=C(C=C2)F)C#N

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)/C(=C/C2=CC=C(C=C2)F)/C#N

InChI

InChI=1S/C18H15FN2O2/c1-10-16(12(3)22)11(2)21-17(10)18(23)14(9-20)8-13-4-6-15(19)7-5-13/h4-8,21H,1-3H3/b14-8+