2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]ethanamide

Systemtic Name: 2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]ethanamide Openeye Name: 2-(3-cyano-5-nitro-2-oxo-1-pyridyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]acetamide CAS Name: 2-(3-cyano-5-nitro-2-oxo-1-pyridinyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]acetamide IUPAC Name: 2-(3-cyano-5-nitro-2-oxopyridin-1-yl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]acetamide Traditional Name: 2-(3-cyano-2-keto-5-nitro-1-pyridyl)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]acetamide Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O4/c1-11-4-5-14(6-12(11)2)13(3)20-17(23)10-21-9-16(22(25)26)7-15(8-19)18(21)24/h4-7,9,13H,10H2,1-3H3,(H,20,23)/t13-/m0/s1