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

Systemtic Name: 2-[(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl]ethanoic acid Openeye Name: 2-[(3R)-3-(tert-butoxycarbonylamino)-4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl]acetic acid CAS Name: 2-[(3R)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl]acetic acid IUPAC Name: 2-[(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl]acetic acid Traditional Name: 2-[(3R)-3-(tert-butoxycarbonylamino)-4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl]acetic acid Formula: C16H20N2O6 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1COC2=CC=CC=C2N(C1=O)CC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1COC2=CC=CC=C2N(C1=O)CC(=O)O

InChI

InChI=1S/C16H20N2O6/c1-16(2,3)24-15(22)17-10-9-23-12-7-5-4-6-11(12)18(14(10)21)8-13(19)20/h4-7,10H,8-9H2,1-3H3,(H,17,22)(H,19,20)/t10-/m1/s1