ethyl 4-[1-(2,4-dinitrophenyl)-3-phenyl-pyrazol-4-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[1-(2,4-dinitrophenyl)-3-phenyl-pyrazol-4-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[1-(2,4-dinitrophenyl)-3-phenyl-pyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[1-(2,4-dinitrophenyl)-3-phenyl-4-pyrazolyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(2,4-dinitrophenyl)-3-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[1-(2,4-dinitrophenyl)-3-phenyl-pyrazol-4-yl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H20N6O7 MolecularWeight: 492.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CN(N=C2C3=CC=CC=C3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CN(N=C2C3=CC=CC=C3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C23H20N6O7/c1-3-36-22(30)19-13(2)24-23(31)25-21(19)16-12-27(26-20(16)14-7-5-4-6-8-14)17-10-9-15(28(32)33)11-18(17)29(34)35/h4-12,21H,3H2,1-2H3,(H2,24,25,31)