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

Systemtic Name: ethyl 4-(3-methyl-6-oxidanylidene-4-pyridin-2-yl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl)benzoate Openeye Name: ethyl 4-[3-methyl-6-oxo-4-(2-pyridyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoate CAS Name: 4-[3-methyl-6-oxo-4-(2-pyridinyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-methyl-6-oxo-4-pyridin-2-yl-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl)benzoate Traditional Name: 4-[6-keto-3-methyl-4-(2-pyridyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-5-yl]benzoic acid ethyl ester Formula: C20H18N4O3 MolecularWeight: 362.38192

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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=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C)C4=CC=CC=N4

InChI

InChI=1S/C20H18N4O3/c1-3-27-20(26)13-7-9-14(10-8-13)24-18(15-6-4-5-11-21-15)16-12(2)22-23-17(16)19(24)25/h4-11,18H,3H2,1-2H3,(H,22,23)