4-(4-cyanophenyl)-2,5-dimethyl-1-(2-oxidanyl-2-pyridin-3-yl-ethyl)pyrrole-3-carbonitrile

Systemtic Name: 4-(4-cyanophenyl)-2,5-dimethyl-1-(2-oxidanyl-2-pyridin-3-yl-ethyl)pyrrole-3-carbonitrile Openeye Name: 4-(4-cyanophenyl)-1-[2-hydroxy-2-(3-pyridyl)ethyl]-2,5-dimethyl-pyrrole-3-carbonitrile CAS Name: 4-(4-cyanophenyl)-1-[2-hydroxy-2-(3-pyridinyl)ethyl]-2,5-dimethyl-3-pyrrolecarbonitrile IUPAC Name: 4-(4-cyanophenyl)-1-(2-hydroxy-2-pyridin-3-ylethyl)-2,5-dimethylpyrrole-3-carbonitrile Traditional Name: 4-(4-cyanophenyl)-1-[2-hydroxy-2-(3-pyridyl)ethyl]-2,5-dimethyl-pyrrole-3-carbonitrile Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC(C2=CN=CC=C2)O)C)C3=CC=C(C=C3)C#N)C#N

Isomeric SMILES

CC1=C(C(=C(N1CC(C2=CN=CC=C2)O)C)C3=CC=C(C=C3)C#N)C#N

InChI

InChI=1S/C21H18N4O/c1-14-19(11-23)21(17-7-5-16(10-22)6-8-17)15(2)25(14)13-20(26)18-4-3-9-24-12-18/h3-9,12,20,26H,13H2,1-2H3