2-(2-fluorophenyl)-3-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile

Systemtic Name: 2-(2-fluorophenyl)-3-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile Openeye Name: 2-(2-fluorophenyl)-3-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enenitrile CAS Name: 2-(2-fluorophenyl)-3-[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenenitrile IUPAC Name: 2-(2-fluorophenyl)-3-[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enenitrile Traditional Name: 2-(2-fluorophenyl)-3-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]acrylonitrile Formula: C21H16FIN2 MolecularWeight: 442.268013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=C(C#N)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=C(C#N)C3=CC=CC=C3F

InChI

InChI=1S/C21H16FIN2/c1-14-11-16(12-17(13-24)20-5-3-4-6-21(20)22)15(2)25(14)19-9-7-18(23)8-10-19/h3-12H,1-2H3