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

Systemtic Name: ethyl 4-[4-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-6-oxidanylidene-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Openeye Name: ethyl 4-[4-(4-hydroxy-3-methoxy-phenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate CAS Name: 4-[4-(4-hydroxy-3-methoxyphenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-hydroxy-3-methoxyphenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Traditional Name: 4-[4-(4-hydroxy-3-methoxy-phenyl)-6-keto-3-methyl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C)C4=CC(=C(C=C4)O)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C)C4=CC(=C(C=C4)O)OC

InChI

InChI=1S/C22H21N3O5/c1-4-30-22(28)13-5-8-15(9-6-13)25-20(14-7-10-16(26)17(11-14)29-3)18-12(2)23-24-19(18)21(25)27/h5-11,20,26H,4H2,1-3H3,(H,23,24)