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

Systemtic Name: N-(4-cyanophenyl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(4-cyanophenyl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(4-cyanophenyl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(4-cyanophenyl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(4-cyanophenyl)-4,5-dimethoxy-2-nitro-benzamide Formula: C16H13N3O5 MolecularWeight: 327.29152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CC=C(C=C2)C#N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CC=C(C=C2)C#N)[N+](=O)[O-])OC

InChI

InChI=1S/C16H13N3O5/c1-23-14-7-12(13(19(21)22)8-15(14)24-2)16(20)18-11-5-3-10(9-17)4-6-11/h3-8H,1-2H3,(H,18,20)