prop-2-enyl 4-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl 4-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: allyl 4-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid allyl ester Formula: C26H25N5O6 MolecularWeight: 503.5066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=O)N3)C)C(=O)OCC=C)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C=C2C3C(=C(NC(=O)N3)C)C(=O)OCC=C)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H25N5O6/c1-4-13-37-25(32)22-16(3)27-26(33)28-24(22)19-15-30(18-9-7-6-8-10-18)29-23(19)17-11-12-21(36-5-2)20(14-17)31(34)35/h4,6-12,14-15,24H,1,5,13H2,2-3H3,(H2,27,28,33)