4-(4-imidazol-1-yl-3-oxidanyl-butyl)benzenecarbonitrile

Systemtic Name: 4-(4-imidazol-1-yl-3-oxidanyl-butyl)benzenecarbonitrile Openeye Name: 4-(3-hydroxy-4-imidazol-1-yl-butyl)benzonitrile CAS Name: 4-[3-hydroxy-4-(1-imidazolyl)butyl]benzonitrile IUPAC Name: 4-(3-hydroxy-4-imidazol-1-ylbutyl)benzonitrile Traditional Name: 4-(3-hydroxy-4-imidazol-1-yl-butyl)benzonitrile Formula: C14H15N3O MolecularWeight: 241.2884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(CN2C=CN=C2)O)C#N

Isomeric SMILES

C1=CC(=CC=C1CCC(CN2C=CN=C2)O)C#N

InChI

InChI=1S/C14H15N3O/c15-9-13-3-1-12(2-4-13)5-6-14(18)10-17-8-7-16-11-17/h1-4,7-8,11,14,18H,5-6,10H2