5-[4-(2-hydroxyphenyl)carbonyl-3-oxidanyl-2-propyl-phenoxy]pentanoic acid

Systemtic Name: 5-[4-(2-hydroxyphenyl)carbonyl-3-oxidanyl-2-propyl-phenoxy]pentanoic acid Openeye Name: 5-[3-hydroxy-4-(2-hydroxybenzoyl)-2-propyl-phenoxy]pentanoic acid CAS Name: 5-[3-hydroxy-4-[(2-hydroxyphenyl)-oxomethyl]-2-propylphenoxy]pentanoic acid IUPAC Name: 5-[3-hydroxy-4-(2-hydroxybenzoyl)-2-propylphenoxy]pentanoic acid Traditional Name: 5-(3-hydroxy-2-propyl-4-salicyloyl-phenoxy)valeric acid Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2O)OCCCCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2O)OCCCCC(=O)O

InChI

InChI=1S/C21H24O6/c1-2-7-15-18(27-13-6-5-10-19(23)24)12-11-16(21(15)26)20(25)14-8-3-4-9-17(14)22/h3-4,8-9,11-12,22,26H,2,5-7,10,13H2,1H3,(H,23,24)