ethyl 6-ethoxy-4-(4-methoxyphenyl)-6-oxidanyl-3-oxidanylidene-2-phenyl-1,4,5,7-tetrahydroindazole-5-carboxylate

Systemtic Name: ethyl 6-ethoxy-4-(4-methoxyphenyl)-6-oxidanyl-3-oxidanylidene-2-phenyl-1,4,5,7-tetrahydroindazole-5-carboxylate Openeye Name: ethyl 6-ethoxy-6-hydroxy-4-(4-methoxyphenyl)-3-oxo-2-phenyl-1,4,5,7-tetrahydroindazole-5-carboxylate CAS Name: 6-ethoxy-6-hydroxy-4-(4-methoxyphenyl)-3-oxo-2-phenyl-1,4,5,7-tetrahydroindazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-ethoxy-6-hydroxy-4-(4-methoxyphenyl)-3-oxo-2-phenyl-1,4,5,7-tetrahydroindazole-5-carboxylate Traditional Name: 6-ethoxy-6-hydroxy-3-keto-4-(4-methoxyphenyl)-2-phenyl-1,4,5,7-tetrahydroindazole-5-carboxylic acid ethyl ester Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C2=C(CC1(O)OCC)NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1C(C2=C(CC1(O)OCC)NN(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H28N2O6/c1-4-32-24(29)22-20(16-11-13-18(31-3)14-12-16)21-19(15-25(22,30)33-5-2)26-27(23(21)28)17-9-7-6-8-10-17/h6-14,20,22,26,30H,4-5,15H2,1-3H3