2-[3-[4-(4-pentanoyl-2-propyl-phenoxy)butoxy]phenyl]ethanoic acid

Systemtic Name: 2-[3-[4-(4-pentanoyl-2-propyl-phenoxy)butoxy]phenyl]ethanoic acid Openeye Name: 2-[3-[4-(4-pentanoyl-2-propyl-phenoxy)butoxy]phenyl]acetic acid CAS Name: 2-[3-[4-[4-(1-oxopentyl)-2-propylphenoxy]butoxy]phenyl]acetic acid IUPAC Name: 2-[3-[4-(4-pentanoyl-2-propylphenoxy)butoxy]phenyl]acetic acid Traditional Name: 2-[3-[4-(2-propyl-4-valeryl-phenoxy)butoxy]phenyl]acetic acid Formula: C26H34O5 MolecularWeight: 426.54516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=CC(=C(C=C1)OCCCCOC2=CC=CC(=C2)CC(=O)O)CCC

Isomeric SMILES

CCCCC(=O)C1=CC(=C(C=C1)OCCCCOC2=CC=CC(=C2)CC(=O)O)CCC

InChI

InChI=1S/C26H34O5/c1-3-5-12-24(27)21-13-14-25(22(19-21)9-4-2)31-16-7-6-15-30-23-11-8-10-20(17-23)18-26(28)29/h8,10-11,13-14,17,19H,3-7,9,12,15-16,18H2,1-2H3,(H,28,29)