2-ethyl-6-(4-methoxyphenyl)-6-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]hexanoic acid

Systemtic Name: 2-ethyl-6-(4-methoxyphenyl)-6-[3-methyl-1,4-bis(oxidanylidene)naphthalen-2-yl]hexanoic acid Openeye Name: 2-ethyl-6-(4-methoxyphenyl)-6-(3-methyl-1,4-dioxo-2-naphthyl)hexanoic acid CAS Name: 2-ethyl-6-(4-methoxyphenyl)-6-(3-methyl-1,4-dioxo-2-naphthalenyl)hexanoic acid IUPAC Name: 2-ethyl-6-(4-methoxyphenyl)-6-(3-methyl-1,4-dioxonaphthalen-2-yl)hexanoic acid Traditional Name: 6-(1,4-diketo-3-methyl-2-naphthyl)-2-ethyl-6-(4-methoxyphenyl)hexanoic acid Formula: C26H28O5 MolecularWeight: 420.49752

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC(C1=CC=C(C=C1)OC)C2=C(C(=O)C3=CC=CC=C3C2=O)C)C(=O)O

Isomeric SMILES

CCC(CCCC(C1=CC=C(C=C1)OC)C2=C(C(=O)C3=CC=CC=C3C2=O)C)C(=O)O

InChI

InChI=1S/C26H28O5/c1-4-17(26(29)30)8-7-11-20(18-12-14-19(31-3)15-13-18)23-16(2)24(27)21-9-5-6-10-22(21)25(23)28/h5-6,9-10,12-15,17,20H,4,7-8,11H2,1-3H3,(H,29,30)