4-[2,4-bis(chloranyl)phenoxy]-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(2,4-dichlorophenoxy)-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)-3-oxo-butanenitrile CAS Name: 4-(2,4-dichlorophenoxy)-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)-3-oxobutanenitrile IUPAC Name: 4-(2,4-dichlorophenoxy)-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)-3-oxobutanenitrile Traditional Name: 4-(2,4-dichlorophenoxy)-3-keto-2-(3-methyl-1H-benzimidazol-3-ium-2-yl)butyronitrile Formula: C18H14Cl2N3O2+ MolecularWeight: 375.22866

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)C(C#N)C(=O)COC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)C(C#N)C(=O)COC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H13Cl2N3O2/c1-23-15-5-3-2-4-14(15)22-18(23)12(9-21)16(24)10-25-17-7-6-11(19)8-13(17)20/h2-8,12H,10H2,1H3/p+1