3-[4-[3,6-bis(dioxidanylmethyl)naphthalen-2-yl]oxybutoxy]naphthalene-2,7-dicarboxylic acid

Systemtic Name: 3-[4-[3,6-bis(dioxidanylmethyl)naphthalen-2-yl]oxybutoxy]naphthalene-2,7-dicarboxylic acid Openeye Name: 3-[4-[[3,6-bis(hydroperoxymethyl)-2-naphthyl]oxy]butoxy]naphthalene-2,7-dicarboxylic acid CAS Name: 3-[4-[[3,6-bis(hydroperoxymethyl)-2-naphthalenyl]oxy]butoxy]naphthalene-2,7-dicarboxylic acid IUPAC Name: 3-[4-[3,6-bis(hydroperoxymethyl)naphthalen-2-yl]oxybutoxy]naphthalene-2,7-dicarboxylic acid Traditional Name: 3-[4-[3,6-bis(hydroperoxymethyl)-2-naphthoxy]butoxy]naphthalene-2,7-dicarboxylic acid Formula: C28H26O10 MolecularWeight: 522.50004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=C(C=C2C=C1COO)COO)OCCCCOC3=C(C=C4C=C(C=CC4=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=CC(=C(C=C2C=C1COO)COO)OCCCCOC3=C(C=C4C=C(C=CC4=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C28H26O10/c29-27(30)20-6-5-19-14-26(24(28(31)32)12-22(19)10-20)36-8-2-1-7-35-25-13-18-4-3-17(15-37-33)9-21(18)11-23(25)16-38-34/h3-6,9-14,33-34H,1-2,7-8,15-16H2,(H,29,30)(H,31,32)