4-(4-chloranyl-3-methyl-phenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-(4-chloro-3-methylphenoxy)-2-(1-methyl-2-benzimidazolyl)-3-oxobutanenitrile IUPAC Name: 4-(4-chloro-3-methylphenoxy)-2-(1-methylbenzimidazol-2-yl)-3-oxobutanenitrile Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-3-keto-2-(1-methylbenzimidazol-2-yl)butyronitrile Formula: C19H16ClN3O2 MolecularWeight: 353.80224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C)Cl

InChI

InChI=1S/C19H16ClN3O2/c1-12-9-13(7-8-15(12)20)25-11-18(24)14(10-21)19-22-16-5-3-4-6-17(16)23(19)2/h3-9,14H,11H2,1-2H3