5-nitro-2-oxidanylidene-1-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]pyridine-3-carbonitrile

Systemtic Name: 5-nitro-2-oxidanylidene-1-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]pyridine-3-carbonitrile Openeye Name: 5-nitro-2-oxo-1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]pyridine-3-carbonitrile CAS Name: 5-nitro-2-oxo-1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]-3-pyridinecarbonitrile IUPAC Name: 5-nitro-2-oxo-1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]pyridine-3-carbonitrile Traditional Name: 2-keto-1-[2-keto-2-(2,4,5-trimethylphenyl)ethyl]-5-nitro-nicotinonitrile Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CN2C=C(C=C(C2=O)C#N)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H15N3O4/c1-10-4-12(3)15(5-11(10)2)16(21)9-19-8-14(20(23)24)6-13(7-18)17(19)22/h4-6,8H,9H2,1-3H3