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

Systemtic Name: 2-acetamido-6-methyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyrimidine-3,5-dicarboxylic acid Openeye Name: 2-acetamido-6-methyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyrimidine-3,5-dicarboxylic acid CAS Name: 2-acetamido-6-methyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyrimidine-3,5-dicarboxylic acid IUPAC Name: 2-acetamido-6-methyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyrimidine-3,5-dicarboxylic acid Traditional Name: 2-acetamido-6-methyl-4-(3-nitrophenyl)-2,4-dihydro-1H-pyrimidine-3,5-dicarboxylic acid Formula: C15H16N4O7 MolecularWeight: 364.31014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N4O7/c1-7-11(13(21)22)12(9-4-3-5-10(6-9)19(25)26)18(15(23)24)14(16-7)17-8(2)20/h3-6,12,14,16H,1-2H3,(H,17,20)(H,21,22)(H,23,24)