5-(1,3-benzodioxol-5-ylmethyl)-4-(4-ethylphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(4-ethylphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(4-ethylphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(4-ethylphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(4-ethylphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: 4-(4-ethylphenyl)-3-phenyl-5-piperonyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)NN=C3C6=CC=CC=C6

Isomeric SMILES

CCC1=CC=C(C=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)NN=C3C6=CC=CC=C6

InChI

InChI=1S/C27H23N3O3/c1-2-17-8-11-20(12-9-17)26-23-24(19-6-4-3-5-7-19)28-29-25(23)27(31)30(26)15-18-10-13-21-22(14-18)33-16-32-21/h3-14,26H,2,15-16H2,1H3,(H,28,29)