(phenylmethyl) N-[1-(2,2-dimethyl-3-oxidanyl-propyl)-3-[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-oxidanylidene-5H-4,1-benzoxazepin-5-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(2,2-dimethyl-3-oxidanyl-propyl)-3-[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-oxidanylidene-5H-4,1-benzoxazepin-5-yl]carbamate Openeye Name: benzyl N-[3-[2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl]-1-(3-hydroxy-2,2-dimethyl-propyl)-2-oxo-5H-4,1-benzoxazepin-5-yl]carbamate CAS Name: N-[3-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-1-(3-hydroxy-2,2-dimethylpropyl)-2-oxo-5H-4,1-benzoxazepin-5-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-1-(3-hydroxy-2,2-dimethylpropyl)-2-oxo-5H-4,1-benzoxazepin-5-yl]carbamate Traditional Name: N-[3-[2-[(2-fluorobenzyl)amino]-2-keto-ethyl]-1-(3-hydroxy-2,2-dimethyl-propyl)-2-keto-5H-4,1-benzoxazepin-5-yl]carbamic acid benzyl ester Formula: C31H34FN3O6 MolecularWeight: 563.616563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1C2=CC=CC=C2C(OC(C1=O)CC(=O)NCC3=CC=CC=C3F)NC(=O)OCC4=CC=CC=C4)CO

Isomeric SMILES

CC(C)(CN1C2=CC=CC=C2C(OC(C1=O)CC(=O)NCC3=CC=CC=C3F)NC(=O)OCC4=CC=CC=C4)CO

InChI

InChI=1S/C31H34FN3O6/c1-31(2,20-36)19-35-25-15-9-7-13-23(25)28(34-30(39)40-18-21-10-4-3-5-11-21)41-26(29(35)38)16-27(37)33-17-22-12-6-8-14-24(22)32/h3-15,26,28,36H,16-20H2,1-2H3,(H,33,37)(H,34,39)