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

Systemtic Name: 3-[2,5-dimethyl-1-(4-phenylmethoxyphenyl)pyrrol-3-yl]-2-(2-fluorophenyl)prop-2-enenitrile Openeye Name: 3-[1-(4-benzyloxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-fluorophenyl)prop-2-enenitrile CAS Name: 3-[2,5-dimethyl-1-(4-phenylmethoxyphenyl)-3-pyrrolyl]-2-(2-fluorophenyl)-2-propenenitrile IUPAC Name: 3-[2,5-dimethyl-1-(4-phenylmethoxyphenyl)pyrrol-3-yl]-2-(2-fluorophenyl)prop-2-enenitrile Traditional Name: 3-[1-(4-benzoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-fluorophenyl)acrylonitrile Formula: C28H23FN2O MolecularWeight: 422.493423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C)C=C(C#N)C4=CC=CC=C4F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C)C=C(C#N)C4=CC=CC=C4F

InChI

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