(1-oxidanyl-9-oxidanylidene-xanthen-3-yl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: (1-oxidanyl-9-oxidanylidene-xanthen-3-yl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (1-hydroxy-9-oxo-xanthen-3-yl) (2R)-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (1-hydroxy-9-oxo-3-xanthenyl) ester IUPAC Name: (1-hydroxy-9-oxoxanthen-3-yl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)propionic acid (1-hydroxy-9-keto-xanthen-3-yl) ester Formula: C21H21NO7 MolecularWeight: 399.39394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC(=C2C(=C1)OC3=CC=CC=C3C2=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C(=O)OC1=CC(=C2C(=C1)OC3=CC=CC=C3C2=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H21NO7/c1-11(22-20(26)29-21(2,3)4)19(25)27-12-9-14(23)17-16(10-12)28-15-8-6-5-7-13(15)18(17)24/h5-11,23H,1-4H3,(H,22,26)/t11-/m1/s1