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

Systemtic Name: 7-(4-chloranyl-3-fluoranyl-phenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one Openeye Name: 7-(4-chloro-3-fluoro-phenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one CAS Name: 7-(4-chloro-3-fluorophenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one IUPAC Name: 7-(4-chloro-3-fluorophenyl)-5,5-dimethyl-1H-4,1-benzoxazepin-2-one Traditional Name: 7-(4-chloro-3-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(=C(C=C3)Cl)F)NC(=O)CO1)C

Isomeric SMILES

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

InChI

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