4-(2-chloranyl-4-nitro-phenoxy)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(2-chloranyl-4-nitro-phenoxy)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: 4-(2-chloro-4-nitro-phenoxy)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: 4-(2-chloro-4-nitrophenoxy)-2-(1,3-dimethyl-2-benzimidazolylidene)-3-oxobutanenitrile IUPAC Name: 4-(2-chloro-4-nitrophenoxy)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-oxobutanenitrile Traditional Name: 4-(2-chloro-4-nitro-phenoxy)-2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-butyronitrile Formula: C19H15ClN4O4 MolecularWeight: 398.7998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C19H15ClN4O4/c1-22-15-5-3-4-6-16(15)23(2)19(22)13(10-21)17(25)11-28-18-8-7-12(24(26)27)9-14(18)20/h3-9H,11H2,1-2H3