copper 2,4-dimethyl-1-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: copper 2,4-dimethyl-1-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: copper 2,4-dimethyl-1-(4-nitrophenyl)-6-oxo-pyrimidine-5-carboxylate CAS Name: copper 2,4-dimethyl-1-(4-nitrophenyl)-6-oxo-5-pyrimidinecarboxylate IUPAC Name: copper 2,4-dimethyl-1-(4-nitrophenyl)-6-oxopyrimidine-5-carboxylate Traditional Name: cupric 6-keto-2,4-dimethyl-1-(4-nitrophenyl)pyrimidine-5-carboxylate Formula: C13H10CuN3O5+ MolecularWeight: 351.7816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-].[Cu+2]

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)C)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-].[Cu+2]

InChI

InChI=1S/C13H11N3O5.Cu/c1-7-11(13(18)19)12(17)15(8(2)14-7)9-3-5-10(6-4-9)16(20)21;/h3-6H,1-2H3,(H,18,19);/q;+2/p-1