4-[2,4,5-trimethyl-1-[[5-(2-oxidanylpropan-2-yl)pyridin-3-yl]methyl]pyrrol-3-yl]benzenecarbonitrile

Systemtic Name: 4-[2,4,5-trimethyl-1-[[5-(2-oxidanylpropan-2-yl)pyridin-3-yl]methyl]pyrrol-3-yl]benzenecarbonitrile Openeye Name: 4-[1-[[5-(1-hydroxy-1-methyl-ethyl)-3-pyridyl]methyl]-2,4,5-trimethyl-pyrrol-3-yl]benzonitrile CAS Name: 4-[1-[[5-(2-hydroxypropan-2-yl)-3-pyridinyl]methyl]-2,4,5-trimethyl-3-pyrrolyl]benzonitrile IUPAC Name: 4-[1-[[5-(2-hydroxypropan-2-yl)pyridin-3-yl]methyl]-2,4,5-trimethylpyrrol-3-yl]benzonitrile Traditional Name: 4-[1-[[5-(1-hydroxy-1-methyl-ethyl)-3-pyridyl]methyl]-2,4,5-trimethyl-pyrrol-3-yl]benzonitrile Formula: C23H25N3O MolecularWeight: 359.4641

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O/c1-15-16(2)26(14-19-10-21(13-25-12-19)23(4,5)27)17(3)22(15)20-8-6-18(11-24)7-9-20/h6-10,12-13,27H,14H2,1-5H3