2-[3-[3-[4-(methylcarbamoyl)-3-oxidanyl-2-propyl-phenoxy]propoxy]-2-propyl-phenoxy]ethanoic acid

Systemtic Name: 2-[3-[3-[4-(methylcarbamoyl)-3-oxidanyl-2-propyl-phenoxy]propoxy]-2-propyl-phenoxy]ethanoic acid Openeye Name: 2-[3-[3-[3-hydroxy-4-(methylcarbamoyl)-2-propyl-phenoxy]propoxy]-2-propyl-phenoxy]acetic acid CAS Name: 2-[3-[3-[3-hydroxy-4-(methylcarbamoyl)-2-propylphenoxy]propoxy]-2-propylphenoxy]acetic acid IUPAC Name: 2-[3-[3-[3-hydroxy-4-(methylcarbamoyl)-2-propylphenoxy]propoxy]-2-propylphenoxy]acetic acid Traditional Name: 2-[3-[3-[3-hydroxy-4-(methylcarbamoyl)-2-propyl-phenoxy]propoxy]-2-propyl-phenoxy]acetic acid Formula: C25H33NO7 MolecularWeight: 459.53202

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OCCCOC2=C(C(=C(C=C2)C(=O)NC)O)CCC)OCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC=C1OCCCOC2=C(C(=C(C=C2)C(=O)NC)O)CCC)OCC(=O)O

InChI

InChI=1S/C25H33NO7/c1-4-8-17-20(10-6-11-21(17)33-16-23(27)28)31-14-7-15-32-22-13-12-19(25(30)26-3)24(29)18(22)9-5-2/h6,10-13,29H,4-5,7-9,14-16H2,1-3H3,(H,26,30)(H,27,28)