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

Systemtic Name: 3-(4-methoxyphenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: 3-(4-methoxyphenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one CAS Name: 3-(4-methoxyphenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 3-(4-methoxyphenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: 3-(4-methoxyphenyl)-5-octyl-4-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O2/c1-3-4-5-6-7-11-18-29-25(20-12-9-8-10-13-20)22-23(27-28-24(22)26(29)30)19-14-16-21(31-2)17-15-19/h8-10,12-17,25H,3-7,11,18H2,1-2H3,(H,27,28)