ethyl 4-[4-(3-ethoxy-4-oxidanyl-phenyl)-3-methyl-6-oxidanylidene-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate

Systemtic Name: ethyl 4-[4-(3-ethoxy-4-oxidanyl-phenyl)-3-methyl-6-oxidanylidene-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Openeye Name: ethyl 4-[4-(3-ethoxy-4-hydroxy-phenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate CAS Name: 4-[4-(3-ethoxy-4-hydroxyphenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-ethoxy-4-hydroxyphenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Traditional Name: 4-[4-(3-ethoxy-4-hydroxy-phenyl)-6-keto-3-methyl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C3=C(NN=C3C(=O)N2C4=CC=C(C=C4)C(=O)OCC)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C3=C(NN=C3C(=O)N2C4=CC=C(C=C4)C(=O)OCC)C)O

InChI

InChI=1S/C23H23N3O5/c1-4-30-18-12-15(8-11-17(18)27)21-19-13(3)24-25-20(19)22(28)26(21)16-9-6-14(7-10-16)23(29)31-5-2/h6-12,21,27H,4-5H2,1-3H3,(H,24,25)