[4-(4-nitrophenoxy)-2-oxidanyl-butyl] 3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [4-(4-nitrophenoxy)-2-oxidanyl-butyl] 3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: [2-hydroxy-4-(4-nitrophenoxy)butyl] 2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: 3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid [2-hydroxy-4-(4-nitrophenoxy)butyl] ester IUPAC Name: [2-hydroxy-4-(4-nitrophenoxy)butyl] 3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propionic acid [2-hydroxy-4-(4-nitrophenoxy)butyl] ester Formula: C24H30N2O9 MolecularWeight: 490.503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)OCC(CCOC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)OCC(CCOC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C24H30N2O9/c1-24(2,3)35-23(30)25-21(14-16-4-8-18(27)9-5-16)22(29)34-15-19(28)12-13-33-20-10-6-17(7-11-20)26(31)32/h4-11,19,21,27-28H,12-15H2,1-3H3,(H,25,30)