7-(3-chloranyl-5-fluoranyl-phenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one

Systemtic Name: 7-(3-chloranyl-5-fluoranyl-phenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one Openeye Name: 7-(3-chloro-5-fluoro-phenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one CAS Name: 7-(3-chloro-5-fluorophenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one IUPAC Name: 7-(3-chloro-5-fluorophenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one Traditional Name: 7-(3-chloro-5-fluoro-phenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one Formula: C17H15ClFNO2 MolecularWeight: 319.757903

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)Cl)F)NC(=O)CO1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)C3=CC(=CC(=C3)Cl)F)NC(=O)CO1)C

InChI

InChI=1S/C17H15ClFNO2/c1-17(2)14-7-10(11-5-12(18)8-13(19)6-11)3-4-15(14)20-16(21)9-22-17/h3-8H,9H2,1-2H3,(H,20,21)