2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2-methoxy-5-nitro-phenoxy)-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2-methoxy-5-nitro-phenoxy)-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2-methoxy-5-nitro-phenoxy)-3-oxo-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-(2-methoxy-5-nitrophenoxy)-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2-methoxy-5-nitrophenoxy)-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-(2-methoxy-5-nitro-phenoxy)butyronitrile Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O5/c1-22-15-6-4-5-7-16(15)23(2)20(22)14(11-21)17(25)12-29-19-10-13(24(26)27)8-9-18(19)28-3/h4-10H,12H2,1-3H3