N-(cyanomethyl)-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-(cyanomethyl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(cyanomethyl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(cyanomethyl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(cyanomethyl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(cyanomethyl)-4,5-dimethoxy-2-nitro-benzamide Formula: C11H11N3O5 MolecularWeight: 265.22214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NCC#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NCC#N)[N+](=O)[O-])OC

InChI

InChI=1S/C11H11N3O5/c1-18-9-5-7(11(15)13-4-3-12)8(14(16)17)6-10(9)19-2/h5-6H,4H2,1-2H3,(H,13,15)