7-[3-(4-ethoxy-2-ethyl-5-oxidanyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid

Systemtic Name: 7-[3-(4-ethoxy-2-ethyl-5-oxidanyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 7-[3-(4-ethoxy-2-ethyl-5-hydroxy-phenoxy)propoxy]-8-propyl-chromane-2-carboxylic acid CAS Name: 7-[3-(4-ethoxy-2-ethyl-5-hydroxyphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-(4-ethoxy-2-ethyl-5-hydroxyphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 7-[3-(4-ethoxy-2-ethyl-5-hydroxy-phenoxy)propoxy]-8-propyl-chroman-2-carboxylic acid Formula: C26H34O7 MolecularWeight: 458.54396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCCCOC3=CC(=C(C=C3CC)OCC)O

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCCCOC3=CC(=C(C=C3CC)OCC)O

InChI

InChI=1S/C26H34O7/c1-4-8-19-21(11-9-18-10-12-22(26(28)29)33-25(18)19)31-13-7-14-32-23-16-20(27)24(30-6-3)15-17(23)5-2/h9,11,15-16,22,27H,4-8,10,12-14H2,1-3H3,(H,28,29)