methyl 4-[5-(2-methoxyethyl)-6-oxidanylidene-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoate

Systemtic Name: methyl 4-[5-(2-methoxyethyl)-6-oxidanylidene-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoate Openeye Name: methyl 4-[5-(2-methoxyethyl)-6-oxo-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoate CAS Name: 4-[5-(2-methoxyethyl)-6-oxo-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(2-methoxyethyl)-6-oxo-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoate Traditional Name: 4-[6-keto-5-(2-methoxyethyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoic acid methyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(C2=C(C1=O)NN=C2C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COCCN1C(C2=C(C1=O)NN=C2C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C22H21N3O4/c1-28-13-12-25-20(15-8-10-16(11-9-15)22(27)29-2)17-18(14-6-4-3-5-7-14)23-24-19(17)21(25)26/h3-11,20H,12-13H2,1-2H3,(H,23,24)