1-cyclopropyl-3-(9-fluoranyl-3,4-dihydro-2H-1,5-benzoxathiepin-6-yl)propane-1,3-dione

Systemtic Name: 1-cyclopropyl-3-(9-fluoranyl-3,4-dihydro-2H-1,5-benzoxathiepin-6-yl)propane-1,3-dione Openeye Name: 1-cyclopropyl-3-(9-fluoro-3,4-dihydro-2H-1,5-benzoxathiepin-6-yl)propane-1,3-dione CAS Name: 1-cyclopropyl-3-(9-fluoro-3,4-dihydro-2H-1,5-benzoxathiepin-6-yl)propane-1,3-dione IUPAC Name: 1-cyclopropyl-3-(9-fluoro-3,4-dihydro-2H-1,5-benzoxathiepin-6-yl)propane-1,3-dione Traditional Name: 1-cyclopropyl-3-(9-fluoro-3,4-dihydro-2H-1,5-benzoxathiepin-6-yl)propane-1,3-dione Formula: C15H15FO3S MolecularWeight: 294.341203

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC(=C2SC1)C(=O)CC(=O)C3CC3)F

Isomeric SMILES

C1COC2=C(C=CC(=C2SC1)C(=O)CC(=O)C3CC3)F

InChI

InChI=1S/C15H15FO3S/c16-11-5-4-10(13(18)8-12(17)9-2-3-9)15-14(11)19-6-1-7-20-15/h4-5,9H,1-3,6-8H2