2,6-bis(fluoranyl)-N-[2-methyl-4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide

Systemtic Name: 2,6-bis(fluoranyl)-N-[2-methyl-4-(3-methylbutyl)-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzamide Openeye Name: 2,6-difluoro-N-(4-isopentyl-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl)benzamide CAS Name: 2,6-difluoro-N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide IUPAC Name: 2,6-difluoro-N-[2-methyl-4-(3-methylbutyl)-3-oxo-5H-1,4-benzoxazepin-7-yl]benzamide Traditional Name: 2,6-difluoro-N-(4-isoamyl-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl)benzamide Formula: C22H24F2N2O3 MolecularWeight: 402.434366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24F2N2O3/c1-13(2)9-10-26-12-15-11-16(7-8-19(15)29-14(3)22(26)28)25-21(27)20-17(23)5-4-6-18(20)24/h4-8,11,13-14H,9-10,12H2,1-3H3,(H,25,27)