[(2-methylpropan-2-yl)oxycarbonylamino] 3-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)propanoate

Systemtic Name: [(2-methylpropan-2-yl)oxycarbonylamino] 3-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)propanoate Openeye Name: (tert-butoxycarbonylamino) 3-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)propanoate CAS Name: 3-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)propanoic acid [[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: [(2-methylpropan-2-yl)oxycarbonylamino] 3-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)propanoate Traditional Name: 3-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)propionic acid (tert-butoxycarbonylamino) ester Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NOC(=O)CCN1C(=O)CCOC2=CC=CC=C21

Isomeric SMILES

CC(C)(C)OC(=O)NOC(=O)CCN1C(=O)CCOC2=CC=CC=C21

InChI

InChI=1S/C17H22N2O6/c1-17(2,3)24-16(22)18-25-15(21)8-10-19-12-6-4-5-7-13(12)23-11-9-14(19)20/h4-7H,8-11H2,1-3H3,(H,18,22)