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

Systemtic Name: (5-methyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl) (2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (1-hydroxy-5-methyl-9-oxo-xanthen-3-yl) (2R)-2-(tert-butoxycarbonylamino)-3-methyl-butanoate CAS Name: (2R)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (1-hydroxy-5-methyl-9-oxo-3-xanthenyl) ester IUPAC Name: (1-hydroxy-5-methyl-9-oxoxanthen-3-yl) (2R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-methyl-butyric acid (1-hydroxy-9-keto-5-methyl-xanthen-3-yl) ester Formula: C24H27NO7 MolecularWeight: 441.47368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC3=CC(=CC(=C3C2=O)O)OC(=O)C(C(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1OC3=CC(=CC(=C3C2=O)O)OC(=O)[C@@H](C(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H27NO7/c1-12(2)19(25-23(29)32-24(4,5)6)22(28)30-14-10-16(26)18-17(11-14)31-21-13(3)8-7-9-15(21)20(18)27/h7-12,19,26H,1-6H3,(H,25,29)/t19-/m1/s1