O3-tert-butyl O5-ethyl 2-azanyl-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate

Systemtic Name: O3-tert-butyl O5-ethyl 2-azanyl-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate Openeye Name: O3-tert-butyl O5-ethyl 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate CAS Name: 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid O3-tert-butyl ester O5-ethyl ester IUPAC Name: 3-O-tert-butyl 5-O-ethyl 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate Traditional Name: 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid O3-tert-butyl ester O5-ethyl ester Formula: C19H24N4O6 MolecularWeight: 404.41706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)(C)C)N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC(C)(C)C)N)C

InChI

InChI=1S/C19H24N4O6/c1-6-28-16(24)14-11(2)21-17(20)22(18(25)29-19(3,4)5)15(14)12-8-7-9-13(10-12)23(26)27/h7-10,15H,6H2,1-5H3,(H2,20,21)