2-[4-[1,2-bis(oxidanyl)ethyl]-2,6-dipropyl-phenoxy]-2-naphthalen-2-yl-ethanoic acid

Systemtic Name: 2-[4-[1,2-bis(oxidanyl)ethyl]-2,6-dipropyl-phenoxy]-2-naphthalen-2-yl-ethanoic acid Openeye Name: 2-[4-(1,2-dihydroxyethyl)-2,6-dipropyl-phenoxy]-2-(2-naphthyl)acetic acid CAS Name: 2-[4-(1,2-dihydroxyethyl)-2,6-dipropylphenoxy]-2-(2-naphthalenyl)acetic acid IUPAC Name: 2-[4-(1,2-dihydroxyethyl)-2,6-dipropylphenoxy]-2-naphthalen-2-ylacetic acid Traditional Name: 2-[4-(1,2-dihydroxyethyl)-2,6-dipropyl-phenoxy]-2-(2-naphthyl)acetic acid Formula: C26H30O5 MolecularWeight: 422.5134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1OC(C2=CC3=CC=CC=C3C=C2)C(=O)O)CCC)C(CO)O

Isomeric SMILES

CCCC1=CC(=CC(=C1OC(C2=CC3=CC=CC=C3C=C2)C(=O)O)CCC)C(CO)O

InChI

InChI=1S/C26H30O5/c1-3-7-19-14-22(23(28)16-27)15-20(8-4-2)24(19)31-25(26(29)30)21-12-11-17-9-5-6-10-18(17)13-21/h5-6,9-15,23,25,27-28H,3-4,7-8,16H2,1-2H3,(H,29,30)