ethyl 4-[4-(4-tert-butylphenyl)-3-methyl-6-oxidanylidene-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate

Systemtic Name: ethyl 4-[4-(4-tert-butylphenyl)-3-methyl-6-oxidanylidene-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Openeye Name: ethyl 4-[4-(4-tert-butylphenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate CAS Name: 4-[4-(4-tert-butylphenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-tert-butylphenyl)-3-methyl-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate Traditional Name: 4-[4-(4-tert-butylphenyl)-6-keto-3-methyl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester Formula: C25H27N3O3 MolecularWeight: 417.50018

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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)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O3/c1-6-31-24(30)17-9-13-19(14-10-17)28-22(20-15(2)26-27-21(20)23(28)29)16-7-11-18(12-8-16)25(3,4)5/h7-14,22H,6H2,1-5H3,(H,26,27)