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

Systemtic Name: (phenylmethyl) N-[3-[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-oxidanylidene-1-propyl-5H-4,1-benzoxazepin-5-yl]carbamate Openeye Name: benzyl N-[3-[2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl]-2-oxo-1-propyl-5H-4,1-benzoxazepin-5-yl]carbamate CAS Name: N-[3-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-oxo-1-propyl-5H-4,1-benzoxazepin-5-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-oxo-1-propyl-5H-4,1-benzoxazepin-5-yl]carbamate Traditional Name: N-[3-[2-[(2-fluorobenzyl)amino]-2-keto-ethyl]-2-keto-1-propyl-5H-4,1-benzoxazepin-5-yl]carbamic acid benzyl ester Formula: C29H30FN3O5 MolecularWeight: 519.564003

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(OC(C1=O)CC(=O)NCC3=CC=CC=C3F)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCN1C2=CC=CC=C2C(OC(C1=O)CC(=O)NCC3=CC=CC=C3F)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H30FN3O5/c1-2-16-33-24-15-9-7-13-22(24)27(32-29(36)37-19-20-10-4-3-5-11-20)38-25(28(33)35)17-26(34)31-18-21-12-6-8-14-23(21)30/h3-15,25,27H,2,16-19H2,1H3,(H,31,34)(H,32,36)