N-(2-chloranyl-4,6-dimethyl-phenyl)-2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-(3-cyano-5-nitro-2-oxo-1-pyridyl)acetamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-(3-cyano-5-nitro-2-oxo-1-pyridinyl)acetamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-(3-cyano-5-nitro-2-oxopyridin-1-yl)acetamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-(3-cyano-2-keto-5-nitro-1-pyridyl)acetamide Formula: C16H13ClN4O4 MolecularWeight: 360.75182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])C

InChI

InChI=1S/C16H13ClN4O4/c1-9-3-10(2)15(13(17)4-9)19-14(22)8-20-7-12(21(24)25)5-11(6-18)16(20)23/h3-5,7H,8H2,1-2H3,(H,19,22)