6-(4-nitrophenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-nitrophenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-nitrophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-nitrophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-nitrophenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(4-nitrophenyl)-1H-pyrimidine-5-carbonitrile Formula: C11H6N4O3 MolecularWeight: 242.19034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=O)N=CN2)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=O)N=CN2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C11H6N4O3/c12-5-9-10(13-6-14-11(9)16)7-1-3-8(4-2-7)15(17)18/h1-4,6H,(H,13,14,16)