[3-(4-nitrophenoxy)-2-oxidanyl-propyl] 2-azanyl-3-(4-hydroxyphenyl)propanoate

Systemtic Name: [3-(4-nitrophenoxy)-2-oxidanyl-propyl] 2-azanyl-3-(4-hydroxyphenyl)propanoate Openeye Name: [2-hydroxy-3-(4-nitrophenoxy)propyl] 2-amino-3-(4-hydroxyphenyl)propanoate CAS Name: 2-amino-3-(4-hydroxyphenyl)propanoic acid [2-hydroxy-3-(4-nitrophenoxy)propyl] ester IUPAC Name: [2-hydroxy-3-(4-nitrophenoxy)propyl] 2-amino-3-(4-hydroxyphenyl)propanoate Traditional Name: 2-amino-3-(4-hydroxyphenyl)propionic acid [2-hydroxy-3-(4-nitrophenoxy)propyl] ester Formula: C18H20N2O7 MolecularWeight: 376.3606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)OCC(COC2=CC=C(C=C2)[N+](=O)[O-])O)N)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)OCC(COC2=CC=C(C=C2)[N+](=O)[O-])O)N)O

InChI

InChI=1S/C18H20N2O7/c19-17(9-12-1-5-14(21)6-2-12)18(23)27-11-15(22)10-26-16-7-3-13(4-8-16)20(24)25/h1-8,15,17,21-22H,9-11,19H2