(1-oxidanyl-9-oxidanylidene-xanthen-3-yl) 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

Systemtic Name: (1-oxidanyl-9-oxidanylidene-xanthen-3-yl) 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Openeye Name: (1-hydroxy-9-oxo-xanthen-3-yl) 6-(tert-butoxycarbonylamino)hexanoate CAS Name: 6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid (1-hydroxy-9-oxo-3-xanthenyl) ester IUPAC Name: (1-hydroxy-9-oxoxanthen-3-yl) 6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate Traditional Name: 6-(tert-butoxycarbonylamino)hexanoic acid (1-hydroxy-9-keto-xanthen-3-yl) ester Formula: C24H27NO7 MolecularWeight: 441.47368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27NO7/c1-24(2,3)32-23(29)25-12-8-4-5-11-20(27)30-15-13-17(26)21-19(14-15)31-18-10-7-6-9-16(18)22(21)28/h6-7,9-10,13-14,26H,4-5,8,11-12H2,1-3H3,(H,25,29)