ethyl 4-[[5-(2-acetyloxyethylsulfonyl)-2-methoxy-phenyl]diazenyl]-5-oxidanylidene-1-phenyl-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 4-[[5-(2-acetyloxyethylsulfonyl)-2-methoxy-phenyl]diazenyl]-5-oxidanylidene-1-phenyl-4H-pyrazole-3-carboxylate Openeye Name: ethyl 4-[5-(2-acetoxyethylsulfonyl)-2-methoxy-phenyl]azo-5-oxo-1-phenyl-4H-pyrazole-3-carboxylate CAS Name: 4-[5-(2-acetyloxyethylsulfonyl)-2-methoxyphenyl]azo-5-oxo-1-phenyl-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(2-acetyloxyethylsulfonyl)-2-methoxyphenyl]diazenyl]-5-oxo-1-phenyl-4H-pyrazole-3-carboxylate Traditional Name: 4-[5-(2-acetoxyethylsulfonyl)-2-methoxy-phenyl]azo-5-keto-1-phenyl-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C23H24N4O8S MolecularWeight: 516.52366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)CCOC(=O)C)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C1N=NC2=C(C=CC(=C2)S(=O)(=O)CCOC(=O)C)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H24N4O8S/c1-4-34-23(30)21-20(22(29)27(26-21)16-8-6-5-7-9-16)25-24-18-14-17(10-11-19(18)33-3)36(31,32)13-12-35-15(2)28/h5-11,14,20H,4,12-13H2,1-3H3