N-[2-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)ethyl]-4-nitro-benzamide

Systemtic Name: N-[2-(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)ethyl]-4-nitro-benzamide Openeye Name: N-[2-(3-cyano-4,6-dimethyl-2-oxo-1-pyridyl)ethyl]-4-nitro-benzamide CAS Name: N-[2-(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)ethyl]-4-nitrobenzamide IUPAC Name: N-[2-(3-cyano-4,6-dimethyl-2-oxopyridin-1-yl)ethyl]-4-nitrobenzamide Traditional Name: N-[2-(3-cyano-2-keto-4,6-dimethyl-1-pyridyl)ethyl]-4-nitro-benzamide Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N)C

InChI

InChI=1S/C17H16N4O4/c1-11-9-12(2)20(17(23)15(11)10-18)8-7-19-16(22)13-3-5-14(6-4-13)21(24)25/h3-6,9H,7-8H2,1-2H3,(H,19,22)