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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3F)CC(C)C

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3F)CC(C)C

InChI

InChI=1S/C22H25FN2O3/c1-4-19-22(27)25(12-14(2)3)13-15-11-16(9-10-20(15)28-19)24-21(26)17-7-5-6-8-18(17)23/h5-11,14,19H,4,12-13H2,1-3H3,(H,24,26)