methyl 3-[(5-fluoranyl-1,3-benzothiazol-2-yl)methoxy]-2-(4-oxidanyl-3,4-dihydro-2H-chromen-3-yl)benzoate

Systemtic Name: methyl 3-[(5-fluoranyl-1,3-benzothiazol-2-yl)methoxy]-2-(4-oxidanyl-3,4-dihydro-2H-chromen-3-yl)benzoate Openeye Name: methyl 3-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-2-(4-hydroxychroman-3-yl)benzoate CAS Name: 3-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-2-(4-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl)benzoic acid methyl ester IUPAC Name: methyl 3-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-2-(4-hydroxy-3,4-dihydro-2H-chromen-3-yl)benzoate Traditional Name: 3-[(5-fluoro-1,3-benzothiazol-2-yl)methoxy]-2-(4-hydroxychroman-3-yl)benzoic acid methyl ester Formula: C25H20FNO5S MolecularWeight: 465.493403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)OCC2=NC3=C(S2)C=CC(=C3)F)C4COC5=CC=CC=C5C4O

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)OCC2=NC3=C(S2)C=CC(=C3)F)C4COC5=CC=CC=C5C4O

InChI

InChI=1S/C25H20FNO5S/c1-30-25(29)16-6-4-8-20(32-13-22-27-18-11-14(26)9-10-21(18)33-22)23(16)17-12-31-19-7-3-2-5-15(19)24(17)28/h2-11,17,24,28H,12-13H2,1H3