2-fluoranyl-N-[2-methyl-4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[2-methyl-4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: 2-fluoro-N-(4-isopentyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)benzamide CAS Name: 2-fluoro-N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: 2-fluoro-N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: 2-fluoro-N-(4-isoamyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)benzamide Formula: C22H25FN2O3 MolecularWeight: 384.443903

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3F)CCC(C)C

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3F)CCC(C)C

InChI

InChI=1S/C22H25FN2O3/c1-14(2)10-11-25-13-16-12-17(8-9-20(16)28-15(3)22(25)27)24-21(26)18-6-4-5-7-19(18)23/h4-9,12,14-15H,10-11,13H2,1-3H3,(H,24,26)