3-(1-imidazol-1-ylpropan-2-yl)-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-(1-imidazol-1-ylpropan-2-yl)-2-oxidanyl-benzenecarbonitrile Openeye Name: 2-hydroxy-3-(2-imidazol-1-yl-1-methyl-ethyl)benzonitrile CAS Name: 2-hydroxy-3-[1-(1-imidazolyl)propan-2-yl]benzonitrile IUPAC Name: 2-hydroxy-3-(1-imidazol-1-ylpropan-2-yl)benzonitrile Traditional Name: 2-hydroxy-3-(2-imidazol-1-yl-1-methyl-ethyl)benzonitrile Formula: C13H13N3O MolecularWeight: 227.26182

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CN=C1)C2=CC=CC(=C2O)C#N

Isomeric SMILES

CC(CN1C=CN=C1)C2=CC=CC(=C2O)C#N

InChI

InChI=1S/C13H13N3O/c1-10(8-16-6-5-15-9-16)12-4-2-3-11(7-14)13(12)17/h2-6,9-10,17H,8H2,1H3