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

Systemtic Name: (5S)-7-chloranyl-5-[(E)-prop-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Openeye Name: (5S)-7-chloro-5-[(E)-prop-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one CAS Name: (5S)-7-chloro-5-[(E)-prop-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one IUPAC Name: (5S)-7-chloro-5-[(E)-prop-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Traditional Name: (5S)-7-chloro-5-[(E)-prop-1-enyl]-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Formula: C13H11ClF3NO2 MolecularWeight: 305.68015

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C/[C@]1(C2=C(C=CC(=C2)Cl)NC(=O)CO1)C(F)(F)F

InChI

InChI=1S/C13H11ClF3NO2/c1-2-5-12(13(15,16)17)9-6-8(14)3-4-10(9)18-11(19)7-20-12/h2-6H,7H2,1H3,(H,18,19)/b5-2+/t12-/m0/s1