6,7-dimethoxy-3-[[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 6,7-dimethoxy-3-[[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]amino]-3H-2-benzofuran-1-one Openeye Name: 6,7-dimethoxy-3-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amino]-3H-isobenzofuran-1-one CAS Name: 6,7-dimethoxy-3-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amino]-3H-isobenzofuran-1-one IUPAC Name: 6,7-dimethoxy-3-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amino]-3H-2-benzofuran-1-one Traditional Name: 6,7-dimethoxy-3-[[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amino]phthalide Formula: C18H13F3N2O5S MolecularWeight: 426.36643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)(F)F)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)NC3=NC4=C(S3)C=C(C=C4)OC(F)(F)F)OC

InChI

InChI=1S/C18H13F3N2O5S/c1-25-11-6-4-9-13(14(11)26-2)16(24)27-15(9)23-17-22-10-5-3-8(7-12(10)29-17)28-18(19,20)21/h3-7,15H,1-2H3,(H,22,23)