ethyl 4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-(5-ethoxycarbonyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxylate

Systemtic Name: ethyl 4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-(5-ethoxycarbonyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methyl]-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxylate Openeye Name: ethyl 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-(5-ethoxycarbonyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylate CAS Name: 4-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-(5-ethoxycarbonyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-(5-ethoxycarbonyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-3-oxo-2-phenyl-1H-pyrazole-5-carboxylate Traditional Name: 4-[(3-carbethoxy-5-keto-1-phenyl-3-pyrazolin-4-yl)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-5-keto-1-phenyl-3-pyrazoline-3-carboxylic acid ethyl ester Formula: C35H31ClN6O6 MolecularWeight: 667.11024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=C(N(N=C3C)C4=CC=CC=C4)Cl)C5=C(NN(C5=O)C6=CC=CC=C6)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(N1)C2=CC=CC=C2)C(C3=C(N(N=C3C)C4=CC=CC=C4)Cl)C5=C(NN(C5=O)C6=CC=CC=C6)C(=O)OCC

InChI

InChI=1S/C35H31ClN6O6/c1-4-47-34(45)29-27(32(43)41(38-29)23-17-11-7-12-18-23)26(25-21(3)37-40(31(25)36)22-15-9-6-10-16-22)28-30(35(46)48-5-2)39-42(33(28)44)24-19-13-8-14-20-24/h6-20,26,38-39H,4-5H2,1-3H3