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

Systemtic Name: N-(2-ethyl-3-oxidanylidene-4-propan-2-yl-5H-1,4-benzoxazepin-7-yl)-2-fluoranyl-benzamide Openeye Name: N-(2-ethyl-4-isopropyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-2-fluoro-benzamide CAS Name: N-(2-ethyl-3-oxo-4-propan-2-yl-5H-1,4-benzoxazepin-7-yl)-2-fluorobenzamide IUPAC Name: N-(2-ethyl-3-oxo-4-propan-2-yl-5H-1,4-benzoxazepin-7-yl)-2-fluorobenzamide Traditional Name: N-(2-ethyl-4-isopropyl-3-keto-5H-1,4-benzoxazepin-7-yl)-2-fluoro-benzamide Formula: C21H23FN2O3 MolecularWeight: 370.417323

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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)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN2O3/c1-4-18-21(26)24(13(2)3)12-14-11-15(9-10-19(14)27-18)23-20(25)16-7-5-6-8-17(16)22/h5-11,13,18H,4,12H2,1-3H3,(H,23,25)