4-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-4-oxidanylidene-2,2-diphenyl-butanenitrile

Systemtic Name: 4-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-4-oxidanylidene-2,2-diphenyl-butanenitrile Openeye Name: 4-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-4-oxo-2,2-diphenyl-butanenitrile CAS Name: 4-[1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-4-oxo-2,2-diphenylbutanenitrile IUPAC Name: 4-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-4-oxo-2,2-diphenylbutanenitrile Traditional Name: 4-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-4-keto-2,2-diphenyl-butyronitrile Formula: C28H23FN2O MolecularWeight: 422.493423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H23FN2O/c1-20-17-26(21(2)31(20)25-15-13-24(29)14-16-25)27(32)18-28(19-30,22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-17H,18H2,1-2H3