tert-butyl N-[2-[2-(2-oxidanylidene-1,5-dihydro-4,1-benzoxazepin-3-yl)ethanoyl-phenyl-amino]propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[2-[2-(2-oxidanylidene-1,5-dihydro-4,1-benzoxazepin-3-yl)ethanoyl-phenyl-amino]propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-methyl-1-(N-[2-(2-oxo-1,5-dihydro-4,1-benzoxazepin-3-yl)acetyl]anilino)ethyl]carbamate CAS Name: N-[2-(N-[1-oxo-2-(2-oxo-1,5-dihydro-4,1-benzoxazepin-3-yl)ethyl]anilino)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(N-[2-(2-oxo-1,5-dihydro-4,1-benzoxazepin-3-yl)acetyl]anilino)propan-2-yl]carbamate Traditional Name: N-[1-(N-[2-(2-keto-1,5-dihydro-4,1-benzoxazepin-3-yl)acetyl]anilino)-1-methyl-ethyl]carbamic acid tert-butyl ester Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(C)N(C1=CC=CC=C1)C(=O)CC2C(=O)NC3=CC=CC=C3CO2

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(C)N(C1=CC=CC=C1)C(=O)CC2C(=O)NC3=CC=CC=C3CO2

InChI

InChI=1S/C25H31N3O5/c1-24(2,3)33-23(31)27-25(4,5)28(18-12-7-6-8-13-18)21(29)15-20-22(30)26-19-14-10-9-11-17(19)16-32-20/h6-14,20H,15-16H2,1-5H3,(H,26,30)(H,27,31)