2-[3-[(3-methanoyl-4-methyl-phenoxy)methyl]-5-[(3-methanoyl-4-nitro-phenoxy)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[(3-methanoyl-4-methyl-phenoxy)methyl]-5-[(3-methanoyl-4-nitro-phenoxy)methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[(3-formyl-4-methyl-phenoxy)methyl]-5-[(3-formyl-4-nitro-phenoxy)methyl]phenoxy]acetic acid CAS Name: 2-[3-[(3-formyl-4-methylphenoxy)methyl]-5-[(3-formyl-4-nitrophenoxy)methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[(3-formyl-4-methylphenoxy)methyl]-5-[(3-formyl-4-nitrophenoxy)methyl]phenoxy]acetic acid Traditional Name: 2-[3-[(3-formyl-4-methyl-phenoxy)methyl]-5-[(3-formyl-4-nitro-phenoxy)methyl]phenoxy]acetic acid Formula: C25H21NO9 MolecularWeight: 479.43554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CC(=CC(=C2)OCC(=O)O)COC3=CC(=C(C=C3)[N+](=O)[O-])C=O)C=O

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CC(=CC(=C2)OCC(=O)O)COC3=CC(=C(C=C3)[N+](=O)[O-])C=O)C=O

InChI

InChI=1S/C25H21NO9/c1-16-2-3-21(9-19(16)11-27)33-13-17-6-18(8-23(7-17)35-15-25(29)30)14-34-22-4-5-24(26(31)32)20(10-22)12-28/h2-12H,13-15H2,1H3,(H,29,30)