ethyl (6aS)-5-(4-chlorophenyl)-4,6-bis(oxidanylidene)-1-phenyl-2,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate

Systemtic Name: ethyl (6aS)-5-(4-chlorophenyl)-4,6-bis(oxidanylidene)-1-phenyl-2,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate Openeye Name: ethyl (6aS)-5-(4-chlorophenyl)-4,6-dioxo-1-phenyl-2,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate CAS Name: (6aS)-5-(4-chlorophenyl)-4,6-dioxo-1-phenyl-2,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6aS)-5-(4-chlorophenyl)-4,6-dioxo-1-phenyl-2,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate Traditional Name: (6aS)-5-(4-chlorophenyl)-4,6-diketo-1-phenyl-2,6a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid ethyl ester Formula: C20H16ClN3O4 MolecularWeight: 397.81174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(C(=O)N(C2=O)C3=CC=C(C=C3)Cl)N(N1)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2[C@@H](C(=O)N(C2=O)C3=CC=C(C=C3)Cl)N(N1)C4=CC=CC=C4

InChI

InChI=1S/C20H16ClN3O4/c1-2-28-20(27)16-15-17(24(22-16)14-6-4-3-5-7-14)19(26)23(18(15)25)13-10-8-12(21)9-11-13/h3-11,17,22H,2H2,1H3/t17-/m0/s1