[2-[4-fluoranyl-3-(phenylcarbonyloxy)phenyl]-1-benzothiophen-6-yl] benzoate

Systemtic Name: [2-[4-fluoranyl-3-(phenylcarbonyloxy)phenyl]-1-benzothiophen-6-yl] benzoate Openeye Name: [2-(3-benzoyloxy-4-fluoro-phenyl)benzothiophen-6-yl] benzoate CAS Name: benzoic acid [2-(3-benzoyloxy-4-fluorophenyl)-1-benzothiophen-6-yl] ester IUPAC Name: [2-(3-benzoyloxy-4-fluorophenyl)-1-benzothiophen-6-yl] benzoate Traditional Name: benzoic acid [2-(3-benzoyloxy-4-fluoro-phenyl)benzothiophen-6-yl] ester Formula: C28H17FO4S MolecularWeight: 468.495583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(S3)C4=CC(=C(C=C4)F)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(S3)C4=CC(=C(C=C4)F)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H17FO4S/c29-23-14-12-20(15-24(23)33-28(31)19-9-5-2-6-10-19)25-16-21-11-13-22(17-26(21)34-25)32-27(30)18-7-3-1-4-8-18/h1-17H