N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(5-nitro-2-oxidanylidene-pyridin-1-yl)ethanamide Openeye Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(5-nitro-2-oxo-1-pyridyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(5-nitro-2-oxo-1-pyridinyl)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(5-nitro-2-oxopyridin-1-yl)acetamide Traditional Name: N-(2-cyanoethyl)-N-(3,5-dimethylphenyl)-2-(2-keto-5-nitro-1-pyridyl)acetamide Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CCC#N)C(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])C

InChI

InChI=1S/C18H18N4O4/c1-13-8-14(2)10-16(9-13)21(7-3-6-19)18(24)12-20-11-15(22(25)26)4-5-17(20)23/h4-5,8-11H,3,7,12H2,1-2H3