5-[(2-nitrophenyl)methyl]-2,6-bis(oxidanylidene)-3-phenyl-pyrimidin-4-olate

Systemtic Name: 5-[(2-nitrophenyl)methyl]-2,6-bis(oxidanylidene)-3-phenyl-pyrimidin-4-olate Openeye Name: 5-[(2-nitrophenyl)methyl]-2,6-dioxo-3-phenyl-pyrimidin-4-olate CAS Name: 5-[(2-nitrophenyl)methyl]-2,6-dioxo-3-phenyl-4-pyrimidinolate IUPAC Name: 5-[(2-nitrophenyl)methyl]-2,6-dioxo-3-phenylpyrimidin-4-olate Traditional Name: 2,6-diketo-5-(2-nitrobenzyl)-3-phenyl-pyrimidin-4-olate Formula: C17H12N3O5- MolecularWeight: 338.29428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)CC3=CC=CC=C3[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)CC3=CC=CC=C3[N+](=O)[O-])[O-]

InChI

InChI=1S/C17H13N3O5/c21-15-13(10-11-6-4-5-9-14(11)20(24)25)16(22)19(17(23)18-15)12-7-2-1-3-8-12/h1-9,22H,10H2,(H,18,21,23)/p-1