2-chloranyl-9-(trifluoromethyl)-5H-benzo[b][1]benzoxepin-6-one

Systemtic Name: 2-chloranyl-9-(trifluoromethyl)-5H-benzo[b][1]benzoxepin-6-one Openeye Name: 2-chloro-9-(trifluoromethyl)-5H-benzo[b][1]benzoxepin-6-one CAS Name: 2-chloro-9-(trifluoromethyl)-5H-benzo[b][1]benzoxepin-6-one IUPAC Name: 2-chloro-9-(trifluoromethyl)-5H-benzo[b][1]benzoxepin-6-one Traditional Name: 2-chloro-9-(trifluoromethyl)-5H-benzo[b][1]benzoxepin-6-one Formula: C15H8ClF3O2 MolecularWeight: 312.67103

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)Cl)OC3=C(C1=O)C=CC(=C3)C(F)(F)F

Isomeric SMILES

C1C2=C(C=C(C=C2)Cl)OC3=C(C1=O)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C15H8ClF3O2/c16-10-3-1-8-5-12(20)11-4-2-9(15(17,18)19)6-14(11)21-13(8)7-10/h1-4,6-7H,5H2