6-(3-nitrophenyl)-4-oxidanylidene-2-pyridin-4-yl-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(3-nitrophenyl)-4-oxidanylidene-2-pyridin-4-yl-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(3-nitrophenyl)-4-oxo-2-(4-pyridyl)-1H-pyrimidine-5-carbonitrile CAS Name: 6-(3-nitrophenyl)-4-oxo-2-pyridin-4-yl-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(3-nitrophenyl)-4-oxo-2-pyridin-4-yl-1H-pyrimidine-5-carbonitrile Traditional Name: 4-keto-6-(3-nitrophenyl)-2-(4-pyridyl)-1H-pyrimidine-5-carbonitrile Formula: C16H9N5O3 MolecularWeight: 319.27436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(C(=O)N=C(N2)C3=CC=NC=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(C(=O)N=C(N2)C3=CC=NC=C3)C#N

InChI

InChI=1S/C16H9N5O3/c17-9-13-14(11-2-1-3-12(8-11)21(23)24)19-15(20-16(13)22)10-4-6-18-7-5-10/h1-8H,(H,19,20,22)