4-[3-(4-fluorophenyl)-7-phenylmethoxy-2,3-dihydro-1,4-benzoxathiin-2-yl]phenol

Systemtic Name: 4-[3-(4-fluorophenyl)-7-phenylmethoxy-2,3-dihydro-1,4-benzoxathiin-2-yl]phenol Openeye Name: 4-[7-benzyloxy-3-(4-fluorophenyl)-2,3-dihydro-1,4-benzoxathiin-2-yl]phenol CAS Name: 4-[3-(4-fluorophenyl)-7-phenylmethoxy-2,3-dihydro-1,4-benzoxathiin-2-yl]phenol IUPAC Name: 4-[3-(4-fluorophenyl)-7-phenylmethoxy-2,3-dihydro-1,4-benzoxathiin-2-yl]phenol Traditional Name: 4-[7-benzoxy-3-(4-fluorophenyl)-2,3-dihydro-1,4-benzoxathiin-2-yl]phenol Formula: C27H21FO3S MolecularWeight: 444.517243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC3=C(C=C2)SC(C(O3)C4=CC=C(C=C4)O)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC3=C(C=C2)SC(C(O3)C4=CC=C(C=C4)O)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H21FO3S/c28-21-10-6-20(7-11-21)27-26(19-8-12-22(29)13-9-19)31-24-16-23(14-15-25(24)32-27)30-17-18-4-2-1-3-5-18/h1-16,26-27,29H,17H2