4-[[4-(4-cyanophenyl)-2-(hydroxymethyl)-3,5-dimethyl-pyrrol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(4-cyanophenyl)-2-(hydroxymethyl)-3,5-dimethyl-pyrrol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(4-cyanophenyl)-2-(hydroxymethyl)-3,5-dimethyl-pyrrol-1-yl]methyl]benzonitrile CAS Name: 4-[[4-(4-cyanophenyl)-2-(hydroxymethyl)-3,5-dimethyl-1-pyrrolyl]methyl]benzonitrile IUPAC Name: 4-[[4-(4-cyanophenyl)-2-(hydroxymethyl)-3,5-dimethylpyrrol-1-yl]methyl]benzonitrile Traditional Name: 4-[[3-(4-cyanophenyl)-2,4-dimethyl-5-methylol-pyrrol-1-yl]methyl]benzonitrile Formula: C22H19N3O MolecularWeight: 341.40576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C2=CC=C(C=C2)C#N)C)CC3=CC=C(C=C3)C#N)CO

Isomeric SMILES

CC1=C(N(C(=C1C2=CC=C(C=C2)C#N)C)CC3=CC=C(C=C3)C#N)CO

InChI

InChI=1S/C22H19N3O/c1-15-21(14-26)25(13-19-5-3-17(11-23)4-6-19)16(2)22(15)20-9-7-18(12-24)8-10-20/h3-10,26H,13-14H2,1-2H3