methyl 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylate

Systemtic Name: methyl 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxidanylidene-pyrimidine-5-carboxylate Openeye Name: methyl 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxo-pyrimidine-5-carboxylate CAS Name: 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxo-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2,2-dimethoxyethyl)-2-(4-nitrophenyl)-6-oxopyrimidine-5-carboxylate Traditional Name: 1-(2,2-dimethoxyethyl)-6-keto-2-(4-nitrophenyl)pyrimidine-5-carboxylic acid methyl ester Formula: C16H17N3O7 MolecularWeight: 363.32208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O7/c1-24-13(25-2)9-18-14(10-4-6-11(7-5-10)19(22)23)17-8-12(15(18)20)16(21)26-3/h4-8,13H,9H2,1-3H3