2-azanyl-4-(2-chloranyl-3-nitro-phenyl)-6-methyl-4H-pyrimidine-3-carboxylic acid

Systemtic Name: 2-azanyl-4-(2-chloranyl-3-nitro-phenyl)-6-methyl-4H-pyrimidine-3-carboxylic acid Openeye Name: 2-amino-4-(2-chloro-3-nitro-phenyl)-6-methyl-4H-pyrimidine-3-carboxylic acid CAS Name: 2-amino-4-(2-chloro-3-nitrophenyl)-6-methyl-4H-pyrimidine-3-carboxylic acid IUPAC Name: 2-amino-4-(2-chloro-3-nitrophenyl)-6-methyl-4H-pyrimidine-3-carboxylic acid Traditional Name: 2-amino-4-(2-chloro-3-nitro-phenyl)-6-methyl-4H-pyrimidine-3-carboxylic acid Formula: C12H11ClN4O4 MolecularWeight: 310.69314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClN4O4/c1-6-5-9(16(12(18)19)11(14)15-6)7-3-2-4-8(10(7)13)17(20)21/h2-5,9H,1H3,(H2,14,15)(H,18,19)