2-azanyl-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid

Systemtic Name: 2-azanyl-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid Openeye Name: 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid CAS Name: 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid IUPAC Name: 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid Traditional Name: 2-amino-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylic acid Formula: C13H12N4O6 MolecularWeight: 320.25758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O6/c1-6-9(11(18)19)10(16(13(20)21)12(14)15-6)7-3-2-4-8(5-7)17(22)23/h2-5,10H,1H3,(H2,14,15)(H,18,19)(H,20,21)