7-chloranyl-5-[(E)-3-methylbut-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one

Systemtic Name: 7-chloranyl-5-[(E)-3-methylbut-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Openeye Name: 7-chloro-5-[(E)-3-methylbut-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one CAS Name: 7-chloro-5-[(E)-3-methylbut-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one IUPAC Name: 7-chloro-5-[(E)-3-methylbut-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Traditional Name: 7-chloro-5-[(E)-3-methylbut-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Formula: C15H15ClF3NO2 MolecularWeight: 333.73331

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)/C=C/C1(C2=C(C=CC(=C2)Cl)NC(=O)CO1)C(F)(F)F

InChI

InChI=1S/C15H15ClF3NO2/c1-9(2)5-6-14(15(17,18)19)11-7-10(16)3-4-12(11)20-13(21)8-22-14/h3-7,9H,8H2,1-2H3,(H,20,21)/b6-5+