1-[(7E)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(2-fluoranylphenoxy)ethanone

Systemtic Name: 1-[(7E)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(2-fluoranylphenoxy)ethanone Openeye Name: 1-[(7E)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(2-fluorophenoxy)ethanone CAS Name: 1-[(7E)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(2-fluorophenoxy)ethanone IUPAC Name: 1-[(7E)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(2-fluorophenoxy)ethanone Traditional Name: 1-[(7E)-3-(1,3-benzodioxol-5-yl)-7-piperonylidene-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-2-(2-fluorophenoxy)ethanone Formula: C30H25FN2O6 MolecularWeight: 528.527703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(N(N=C2C(=CC3=CC4=C(C=C3)OCO4)C1)C(=O)COC5=CC=CC=C5F)C6=CC7=C(C=C6)OCO7

Isomeric SMILES

C1CC2C(N(N=C2/C(=C/C3=CC4=C(C=C3)OCO4)/C1)C(=O)COC5=CC=CC=C5F)C6=CC7=C(C=C6)OCO7

InChI

InChI=1S/C30H25FN2O6/c31-22-6-1-2-7-23(22)35-15-28(34)33-30(20-9-11-25-27(14-20)39-17-37-25)21-5-3-4-19(29(21)32-33)12-18-8-10-24-26(13-18)38-16-36-24/h1-2,6-14,21,30H,3-5,15-17H2/b19-12+