2-methyl-2-[4-[2-(4-nitrophenyl)-1-oxidanyl-ethyl]phenoxy]propanoic acid

Systemtic Name: 2-methyl-2-[4-[2-(4-nitrophenyl)-1-oxidanyl-ethyl]phenoxy]propanoic acid Openeye Name: 2-[4-[1-hydroxy-2-(4-nitrophenyl)ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[1-hydroxy-2-(4-nitrophenyl)ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[1-hydroxy-2-(4-nitrophenyl)ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[1-hydroxy-2-(4-nitrophenyl)ethyl]phenoxy]-2-methyl-propionic acid Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)C(CC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)C(CC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H19NO6/c1-18(2,17(21)22)25-15-9-5-13(6-10-15)16(20)11-12-3-7-14(8-4-12)19(23)24/h3-10,16,20H,11H2,1-2H3,(H,21,22)