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

Systemtic Name: methyl 4-[3-methyl-5-(4-methylphenyl)-6-oxidanylidene-2,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoate Openeye Name: methyl 4-[3-methyl-6-oxo-5-(p-tolyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoate CAS Name: 4-[3-methyl-5-(4-methylphenyl)-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-methyl-5-(4-methylphenyl)-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoate Traditional Name: 4-[6-keto-3-methyl-5-(p-tolyl)-2,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoic acid methyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C3=C(NN=C3C2=O)C)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C21H19N3O3/c1-12-4-10-16(11-5-12)24-19(17-13(2)22-23-18(17)20(24)25)14-6-8-15(9-7-14)21(26)27-3/h4-11,19H,1-3H3,(H,22,23)