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

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(3-ethoxyphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(3-ethoxyphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(3-ethoxyphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-4-(3-ethoxyphenyl)-3-phenyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Traditional Name: 4-m-phenetyl-3-phenyl-5-piperonyl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)NN=C3C6=CC=CC=C6

Isomeric SMILES

CCOC1=CC=CC(=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)NN=C3C6=CC=CC=C6

InChI

InChI=1S/C27H23N3O4/c1-2-32-20-10-6-9-19(14-20)26-23-24(18-7-4-3-5-8-18)28-29-25(23)27(31)30(26)15-17-11-12-21-22(13-17)34-16-33-21/h3-14,26H,2,15-16H2,1H3,(H,28,29)