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

Systemtic Name: N-[2-ethyl-3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-3-fluoranyl-benzamide Openeye Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluoro-benzamide CAS Name: N-[2-ethyl-3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]-3-fluorobenzamide IUPAC Name: N-(4-benzyl-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-3-fluorobenzamide Traditional Name: N-(4-benzyl-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl)-3-fluoro-benzamide Formula: C25H23FN2O3 MolecularWeight: 418.460123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)F)CC4=CC=CC=C4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC=C3)F)CC4=CC=CC=C4

InChI

InChI=1S/C25H23FN2O3/c1-2-22-25(30)28(15-17-7-4-3-5-8-17)16-19-14-21(11-12-23(19)31-22)27-24(29)18-9-6-10-20(26)13-18/h3-14,22H,2,15-16H2,1H3,(H,27,29)