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

Systemtic Name: N,N-bis(cyanomethyl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N,N-bis(cyanomethyl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N,N-bis(cyanomethyl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N,N-bis(cyanomethyl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N,N-bis(cyanomethyl)-4,5-dimethoxy-2-nitro-benzamide Formula: C13H12N4O5 MolecularWeight: 304.25818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O5/c1-21-11-7-9(10(17(19)20)8-12(11)22-2)13(18)16(5-3-14)6-4-15/h7-8H,5-6H2,1-2H3