7-methoxy-5-(3-methylbutyl)-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one

Systemtic Name: 7-methoxy-5-(3-methylbutyl)-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Openeye Name: 5-isopentyl-7-methoxy-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one CAS Name: 7-methoxy-5-(3-methylbutyl)-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one IUPAC Name: 7-methoxy-5-(3-methylbutyl)-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Traditional Name: 5-isoamyl-7-methoxy-5-(trifluoromethyl)-1H-4,1-benzoxazepin-2-one Formula: C16H20F3NO3 MolecularWeight: 331.33011

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(C2=C(C=CC(=C2)OC)NC(=O)CO1)C(F)(F)F

Isomeric SMILES

CC(C)CCC1(C2=C(C=CC(=C2)OC)NC(=O)CO1)C(F)(F)F

InChI

InChI=1S/C16H20F3NO3/c1-10(2)6-7-15(16(17,18)19)12-8-11(22-3)4-5-13(12)20-14(21)9-23-15/h4-5,8,10H,6-7,9H2,1-3H3,(H,20,21)