4-[1-(3-methoxyphenyl)-2-oxidanyl-2-oxidanylidene-ethoxy]-3,5-dipropyl-benzoic acid

Systemtic Name: 4-[1-(3-methoxyphenyl)-2-oxidanyl-2-oxidanylidene-ethoxy]-3,5-dipropyl-benzoic acid Openeye Name: 4-[2-hydroxy-1-(3-methoxyphenyl)-2-oxo-ethoxy]-3,5-dipropyl-benzoic acid CAS Name: 4-[2-hydroxy-1-(3-methoxyphenyl)-2-oxoethoxy]-3,5-dipropylbenzoic acid IUPAC Name: 4-[2-hydroxy-1-(3-methoxyphenyl)-2-oxoethoxy]-3,5-dipropylbenzoic acid Traditional Name: 4-[2-hydroxy-2-keto-1-(3-methoxyphenyl)ethoxy]-3,5-dipropyl-benzoic acid Formula: C22H26O6 MolecularWeight: 386.43824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=CC(=C1OC(C2=CC(=CC=C2)OC)C(=O)O)CCC)C(=O)O

Isomeric SMILES

CCCC1=CC(=CC(=C1OC(C2=CC(=CC=C2)OC)C(=O)O)CCC)C(=O)O

InChI

InChI=1S/C22H26O6/c1-4-7-14-11-17(21(23)24)12-15(8-5-2)19(14)28-20(22(25)26)16-9-6-10-18(13-16)27-3/h6,9-13,20H,4-5,7-8H2,1-3H3,(H,23,24)(H,25,26)