7-[2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid

Systemtic Name: 7-[2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 7-[2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-8-propyl-chromane-2-carboxylic acid CAS Name: 7-[2-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[2-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 7-[2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-8-propyl-chroman-2-carboxylic acid Formula: C27H34O7 MolecularWeight: 470.55466

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCC(C)OC3=C(C(=C(C=C3)C(=O)C)O)CCC

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCC(C)OC3=C(C(=C(C=C3)C(=O)C)O)CCC

InChI

InChI=1S/C27H34O7/c1-5-7-20-23(14-11-19(17(4)28)25(20)29)33-16(3)15-32-22-12-9-18-10-13-24(27(30)31)34-26(18)21(22)8-6-2/h9,11-12,14,16,24,29H,5-8,10,13,15H2,1-4H3,(H,30,31)