5-[[2-butyl-5-chloranyl-4-(hydroxymethyl)imidazol-1-yl]methyl]-2-phenyl-benzenecarbonitrile

Systemtic Name: 5-[[2-butyl-5-chloranyl-4-(hydroxymethyl)imidazol-1-yl]methyl]-2-phenyl-benzenecarbonitrile Openeye Name: 5-[[2-butyl-5-chloro-4-(hydroxymethyl)imidazol-1-yl]methyl]-2-phenyl-benzonitrile CAS Name: 5-[[2-butyl-5-chloro-4-(hydroxymethyl)-1-imidazolyl]methyl]-2-phenylbenzonitrile IUPAC Name: 5-[[2-butyl-5-chloro-4-(hydroxymethyl)imidazol-1-yl]methyl]-2-phenylbenzonitrile Traditional Name: 5-[(2-butyl-5-chloro-4-methylol-imidazol-1-yl)methyl]-2-phenyl-benzonitrile Formula: C22H22ClN3O MolecularWeight: 379.88258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)Cl)CO

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C#N)Cl)CO

InChI

InChI=1S/C22H22ClN3O/c1-2-3-9-21-25-20(15-27)22(23)26(21)14-16-10-11-19(18(12-16)13-24)17-7-5-4-6-8-17/h4-8,10-12,27H,2-3,9,14-15H2,1H3