1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylic acid

Systemtic Name: 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylic acid Openeye Name: 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxo-pyrimidine-5-carboxylic acid CAS Name: 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxo-5-pyrimidinecarboxylic acid IUPAC Name: 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxopyrimidine-5-carboxylic acid Traditional Name: 1-(2,2-dimethoxyethyl)-6-keto-2-(4-nitrophenyl)pyrimidine-5-carboxylic acid Formula: C15H15N3O7 MolecularWeight: 349.2955

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1C(=NC=C(C1=O)C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC(CN1C(=NC=C(C1=O)C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H15N3O7/c1-24-12(25-2)8-17-13(16-7-11(14(17)19)15(20)21)9-3-5-10(6-4-9)18(22)23/h3-7,12H,8H2,1-2H3,(H,20,21)