2-[2-(1,3-benzodioxol-5-yl)-5-(trifluoromethyloxy)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-5-(trifluoromethyloxy)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-5-(trifluoromethoxy)-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-5-(trifluoromethoxy)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-5-(trifluoromethoxy)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-5-(trifluoromethoxy)-1H-indol-3-yl]acetic acid Formula: C18H12F3NO5 MolecularWeight: 379.28679

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C4=C(N3)C=CC(=C4)OC(F)(F)F)CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C4=C(N3)C=CC(=C4)OC(F)(F)F)CC(=O)O

InChI

InChI=1S/C18H12F3NO5/c19-18(20,21)27-10-2-3-13-11(6-10)12(7-16(23)24)17(22-13)9-1-4-14-15(5-9)26-8-25-14/h1-6,22H,7-8H2,(H,23,24)