N-(3-cyanothiophen-2-yl)-4-methoxy-3-nitro-benzamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-4-methoxy-3-nitro-benzamide Openeye Name: N-(3-cyano-2-thienyl)-4-methoxy-3-nitro-benzamide CAS Name: N-(3-cyano-2-thiophenyl)-4-methoxy-3-nitrobenzamide IUPAC Name: N-(3-cyanothiophen-2-yl)-4-methoxy-3-nitrobenzamide Traditional Name: N-(3-cyano-2-thienyl)-4-methoxy-3-nitro-benzamide Formula: C13H9N3O4S MolecularWeight: 303.29326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CS2)C#N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CS2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O4S/c1-20-11-3-2-8(6-10(11)16(18)19)12(17)15-13-9(7-14)4-5-21-13/h2-6H,1H3,(H,15,17)