O3-ethyl O5-propan-2-yl 6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-1,4-dihydropyrimidine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-propan-2-yl 6-methyl-4-(3-nitrophenyl)-2-oxidanylidene-1,4-dihydropyrimidine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-isopropyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-3,5-dicarboxylate CAS Name: 6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-3,5-dicarboxylic acid O3-ethyl ester O5-propan-2-yl ester IUPAC Name: 3-O-ethyl 5-O-propan-2-yl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,4-dihydropyrimidine-3,5-dicarboxylate Traditional Name: 2-keto-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyrimidine-3,5-dicarboxylic acid O3-ethyl ester O5-isopropyl ester Formula: C18H21N3O7 MolecularWeight: 391.37524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=C(NC1=O)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1C(C(=C(NC1=O)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O7/c1-5-27-18(24)20-15(12-7-6-8-13(9-12)21(25)26)14(11(4)19-17(20)23)16(22)28-10(2)3/h6-10,15H,5H2,1-4H3,(H,19,23)