5-methyl-7-(2-nitrophenyl)-2-oxidanylidene-4,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid

Systemtic Name: 5-methyl-7-(2-nitrophenyl)-2-oxidanylidene-4,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid Openeye Name: 5-methyl-7-(2-nitrophenyl)-2-oxo-4,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-7-(2-nitrophenyl)-2-oxo-4,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid IUPAC Name: 5-methyl-7-(2-nitrophenyl)-2-oxo-4,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid Traditional Name: 2-keto-5-methyl-7-(2-nitrophenyl)-4,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylic acid Formula: C14H12N4O5 MolecularWeight: 316.26888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=CC(=O)N2)N1)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(N2C(=CC(=O)N2)N1)C3=CC=CC=C3[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H12N4O5/c1-7-12(14(20)21)13(17-10(15-7)6-11(19)16-17)8-4-2-3-5-9(8)18(22)23/h2-6,13,15H,1H3,(H,16,19)(H,20,21)