3-(1,3-benzothiazol-2-yl)-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one CAS Name: 3-(1,3-benzothiazol-2-yl)-7-[[3-(trifluoromethyl)phenyl]methoxy]-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-7-[[3-(trifluoromethyl)phenyl]methoxy]chromen-2-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-7-[3-(trifluoromethyl)benzyl]oxy-coumarin Formula: C24H14F3NO3S MolecularWeight: 453.43307

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C(C=C4)OCC5=CC(=CC=C5)C(F)(F)F)OC3=O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC4=C(C=C(C=C4)OCC5=CC(=CC=C5)C(F)(F)F)OC3=O

InChI

InChI=1S/C24H14F3NO3S/c25-24(26,27)16-5-3-4-14(10-16)13-30-17-9-8-15-11-18(23(29)31-20(15)12-17)22-28-19-6-1-2-7-21(19)32-22/h1-12H,13H2