3-butyl-3-ethyl-7-fluoranyl-1,1-bis(oxidanylidene)-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol

Systemtic Name: 3-butyl-3-ethyl-7-fluoranyl-1,1-bis(oxidanylidene)-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Openeye Name: 3-butyl-3-ethyl-7-fluoro-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol CAS Name: 3-butyl-3-ethyl-7-fluoro-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol IUPAC Name: 3-butyl-3-ethyl-7-fluoro-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Traditional Name: 3-butyl-3-ethyl-7-fluoro-1,1-diketo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Formula: C22H27FO3S MolecularWeight: 390.511383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CS(=O)(=O)C2=C(C=C(C=C2)F)C(C1O)C3=CC=CC=C3)CC

Isomeric SMILES

CCCCC1(CS(=O)(=O)C2=C(C=C(C=C2)F)C(C1O)C3=CC=CC=C3)CC

InChI

InChI=1S/C22H27FO3S/c1-3-5-13-22(4-2)15-27(25,26)19-12-11-17(23)14-18(19)20(21(22)24)16-9-7-6-8-10-16/h6-12,14,20-21,24H,3-5,13,15H2,1-2H3