3-(4-chlorophenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: 3-(4-chlorophenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: 3-(4-chlorophenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one CAS Name: 3-(4-chlorophenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 3-(4-chlorophenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: 3-(4-chlorophenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Formula: C25H28ClN3O MolecularWeight: 421.96232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(C2=C(C1=O)NN=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCN1C(C2=C(C1=O)NN=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H28ClN3O/c1-2-3-4-5-6-10-17-29-24(19-11-8-7-9-12-19)21-22(27-28-23(21)25(29)30)18-13-15-20(26)16-14-18/h7-9,11-16,24H,2-6,10,17H2,1H3,(H,27,28)