2-methyl-2-[3-[(5-methylimidazol-1-yl)methyl]-5-(2-oxidanylpropan-2-yl)phenyl]propanenitrile

Systemtic Name: 2-methyl-2-[3-[(5-methylimidazol-1-yl)methyl]-5-(2-oxidanylpropan-2-yl)phenyl]propanenitrile Openeye Name: 2-[3-(1-hydroxy-1-methyl-ethyl)-5-[(5-methylimidazol-1-yl)methyl]phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(2-hydroxypropan-2-yl)-5-[(5-methyl-1-imidazolyl)methyl]phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(2-hydroxypropan-2-yl)-5-[(5-methylimidazol-1-yl)methyl]phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(1-hydroxy-1-methyl-ethyl)-5-[(5-methylimidazol-1-yl)methyl]phenyl]-2-methyl-propionitrile Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=CN1CC2=CC(=CC(=C2)C(C)(C)O)C(C)(C)C#N

Isomeric SMILES

CC1=CN=CN1CC2=CC(=CC(=C2)C(C)(C)O)C(C)(C)C#N

InChI

InChI=1S/C18H23N3O/c1-13-9-20-12-21(13)10-14-6-15(17(2,3)11-19)8-16(7-14)18(4,5)22/h6-9,12,22H,10H2,1-5H3