methyl (2S)-3-oxidanyl-2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]propanoate

Systemtic Name: methyl (2S)-3-oxidanyl-2-[2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanoylamino]propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[1-oxo-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[[2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetyl]amino]propionic acid methyl ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CN1C(=O)CCOC2=CC=CC=C21

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)CN1C(=O)CCOC2=CC=CC=C21

InChI

InChI=1S/C15H18N2O6/c1-22-15(21)10(9-18)16-13(19)8-17-11-4-2-3-5-12(11)23-7-6-14(17)20/h2-5,10,18H,6-9H2,1H3,(H,16,19)/t10-/m0/s1