N-[2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-(3-methoxyphenyl)ethanamide

Systemtic Name: N-[2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-2-(3-methoxyphenyl)ethanamide Openeye Name: N-[2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-(3-methoxyphenyl)acetamide CAS Name: N-[2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-(3-methoxyphenyl)acetamide IUPAC Name: N-[2-ethyl-4-[(4-fluorophenyl)methyl]-3-oxo-5H-1,4-benzoxazepin-7-yl]-2-(3-methoxyphenyl)acetamide Traditional Name: N-[2-ethyl-4-(4-fluorobenzyl)-3-keto-5H-1,4-benzoxazepin-7-yl]-2-(3-methoxyphenyl)acetamide Formula: C27H27FN2O4 MolecularWeight: 462.512683

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC(=CC=C3)OC)CC4=CC=C(C=C4)F

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)CC3=CC(=CC=C3)OC)CC4=CC=C(C=C4)F

InChI

InChI=1S/C27H27FN2O4/c1-3-24-27(32)30(16-18-7-9-21(28)10-8-18)17-20-15-22(11-12-25(20)34-24)29-26(31)14-19-5-4-6-23(13-19)33-2/h4-13,15,24H,3,14,16-17H2,1-2H3,(H,29,31)