tert-butyl 2-[(3S)-3-azanyl-4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl]ethanoate

Systemtic Name: tert-butyl 2-[(3S)-3-azanyl-4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl]ethanoate Openeye Name: tert-butyl 2-[(3S)-3-amino-4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl]acetate CAS Name: 2-[(3S)-3-amino-4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(3S)-3-amino-4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl]acetate Traditional Name: 2-[(3S)-3-amino-4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl]acetic acid tert-butyl ester Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C2=CC=CC=C2OCC(C1=O)N

Isomeric SMILES

CC(C)(C)OC(=O)CN1C2=CC=CC=C2OC[C@@H](C1=O)N

InChI

InChI=1S/C15H20N2O4/c1-15(2,3)21-13(18)8-17-11-6-4-5-7-12(11)20-9-10(16)14(17)19/h4-7,10H,8-9,16H2,1-3H3/t10-/m0/s1