N-(3-chloranyl-4-cyano-phenyl)-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-(3-chloro-4-cyanophenyl)-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-3,4,5-trimethoxy-2-nitro-benzamide Formula: C17H14ClN3O6 MolecularWeight: 391.76256

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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)Cl)[N+](=O)[O-])OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClN3O6/c1-25-13-7-11(14(21(23)24)16(27-3)15(13)26-2)17(22)20-10-5-4-9(8-19)12(18)6-10/h4-7H,1-3H3,(H,20,22)