5-nitro-2-oxidanylidene-1-[2-oxidanylidene-2-(4-propan-2-ylphenyl)ethyl]pyridine-3-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O4/c1-11(2)12-3-5-13(6-4-12)16(21)10-19-9-15(20(23)24)7-14(8-18)17(19)22/h3-7,9,11H,10H2,1-2H3