3-[1-(1H-imidazol-5-yl)ethyl]-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-[1-(1H-imidazol-5-yl)ethyl]-2-oxidanyl-benzenecarbonitrile Openeye Name: 2-hydroxy-3-[1-(1H-imidazol-5-yl)ethyl]benzonitrile CAS Name: 2-hydroxy-3-[1-(1H-imidazol-5-yl)ethyl]benzonitrile IUPAC Name: 2-hydroxy-3-[1-(1H-imidazol-5-yl)ethyl]benzonitrile Traditional Name: 2-hydroxy-3-[1-(1H-imidazol-5-yl)ethyl]benzonitrile Formula: C12H11N3O MolecularWeight: 213.23524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1O)C#N)C2=CN=CN2

Isomeric SMILES

CC(C1=CC=CC(=C1O)C#N)C2=CN=CN2

InChI

InChI=1S/C12H11N3O/c1-8(11-6-14-7-15-11)10-4-2-3-9(5-13)12(10)16/h2-4,6-8,16H,1H3,(H,14,15)