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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C2C(C3=CC=CC=C3OC2OCC4=NC5=C(S4)C=CC(=C5)F)O

Isomeric SMILES

COC(=O)C1=CC=CC=C1C2C(C3=CC=CC=C3OC2OCC4=NC5=C(S4)C=CC(=C5)F)O

InChI

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