3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-(4-fluorophenyl)prop-2-enenitrile

Systemtic Name: 3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-(4-fluorophenyl)prop-2-enenitrile Openeye Name: 3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-(4-fluorophenyl)prop-2-enenitrile CAS Name: 3-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-2-(4-fluorophenyl)-2-propenenitrile IUPAC Name: 3-(2,5-dimethyl-1-phenylpyrrol-3-yl)-2-(4-fluorophenyl)prop-2-enenitrile Traditional Name: 3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-(4-fluorophenyl)acrylonitrile Formula: C21H17FN2 MolecularWeight: 316.371483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C=C(C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C=C(C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17FN2/c1-15-12-18(16(2)24(15)21-6-4-3-5-7-21)13-19(14-23)17-8-10-20(22)11-9-17/h3-13H,1-2H3