phenyl 2-[1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-2-oxidanylidene-5H-4,1-benzoxazepin-3-yl]ethanoate

Systemtic Name: phenyl 2-[1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-2-oxidanylidene-5H-4,1-benzoxazepin-3-yl]ethanoate Openeye Name: phenyl 2-[1-[1-(tert-butoxycarbonylamino)-1-methyl-ethyl]-2-oxo-5H-4,1-benzoxazepin-3-yl]acetate CAS Name: 2-[1-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propan-2-yl]-2-oxo-5H-4,1-benzoxazepin-3-yl]acetic acid phenyl ester IUPAC Name: phenyl 2-[1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propan-2-yl]-2-oxo-5H-4,1-benzoxazepin-3-yl]acetate Traditional Name: 2-[1-[1-(tert-butoxycarbonylamino)-1-methyl-ethyl]-2-keto-5H-4,1-benzoxazepin-3-yl]acetic acid phenyl ester Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(C)N1C2=CC=CC=C2COC(C1=O)CC(=O)OC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(C)N1C2=CC=CC=C2COC(C1=O)CC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O6/c1-24(2,3)33-23(30)26-25(4,5)27-19-14-10-9-11-17(19)16-31-20(22(27)29)15-21(28)32-18-12-7-6-8-13-18/h6-14,20H,15-16H2,1-5H3,(H,26,30)