6-methyl-4-nitramido-2-(3-nitrophenyl)-2,5-dihydro-1H-pyrimidine-6-carboxylic acid

Systemtic Name: 6-methyl-4-nitramido-2-(3-nitrophenyl)-2,5-dihydro-1H-pyrimidine-6-carboxylic acid Openeye Name: 6-methyl-4-nitramido-2-(3-nitrophenyl)-2,5-dihydro-1H-pyrimidine-6-carboxylic acid CAS Name: 6-methyl-4-nitramido-2-(3-nitrophenyl)-2,5-dihydro-1H-pyrimidine-6-carboxylic acid IUPAC Name: 6-methyl-4-nitramido-2-(3-nitrophenyl)-2,5-dihydro-1H-pyrimidine-6-carboxylic acid Traditional Name: 6-methyl-4-nitramido-2-(3-nitrophenyl)-2,5-dihydro-1H-pyrimidine-6-carboxylic acid Formula: C12H13N5O6 MolecularWeight: 323.26152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N5O6/c1-12(11(18)19)6-9(15-17(22)23)13-10(14-12)7-3-2-4-8(5-7)16(20)21/h2-5,10,14H,6H2,1H3,(H,13,15)(H,18,19)