(2R)-2-(1H-benzimidazol-2-yl)-4-(4-chloranylphenoxy)-3-oxidanylidene-butanenitrile

Systemtic Name: (2R)-2-(1H-benzimidazol-2-yl)-4-(4-chloranylphenoxy)-3-oxidanylidene-butanenitrile Openeye Name: (2R)-2-(1H-benzimidazol-2-yl)-4-(4-chlorophenoxy)-3-oxo-butanenitrile CAS Name: (2R)-2-(1H-benzimidazol-2-yl)-4-(4-chlorophenoxy)-3-oxobutanenitrile IUPAC Name: (2R)-2-(1H-benzimidazol-2-yl)-4-(4-chlorophenoxy)-3-oxobutanenitrile Traditional Name: (2R)-2-(1H-benzimidazol-2-yl)-4-(4-chlorophenoxy)-3-keto-butyronitrile Formula: C17H12ClN3O2 MolecularWeight: 325.74908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C(C#N)C(=O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)[C@@H](C#N)C(=O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H12ClN3O2/c18-11-5-7-12(8-6-11)23-10-16(22)13(9-19)17-20-14-3-1-2-4-15(14)21-17/h1-8,13H,10H2,(H,20,21)/t13-/m0/s1