6-ethanoyl-7-[5-(4-ethanoyl-3-oxidanyl-phenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid

Systemtic Name: 6-ethanoyl-7-[5-(4-ethanoyl-3-oxidanyl-phenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 6-acetyl-7-[5-(4-acetyl-3-hydroxy-phenoxy)pentoxy]chromane-2-carboxylic acid CAS Name: 6-acetyl-7-[5-(4-acetyl-3-hydroxyphenoxy)pentoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 6-acetyl-7-[5-(4-acetyl-3-hydroxyphenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 6-acetyl-7-[5-(4-acetyl-3-hydroxy-phenoxy)pentoxy]chroman-2-carboxylic acid Formula: C25H28O8 MolecularWeight: 456.48502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCCCCCOC2=CC3=C(CCC(O3)C(=O)O)C=C2C(=O)C)O

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCCCCCOC2=CC3=C(CCC(O3)C(=O)O)C=C2C(=O)C)O

InChI

InChI=1S/C25H28O8/c1-15(26)19-8-7-18(13-21(19)28)31-10-4-3-5-11-32-24-14-23-17(12-20(24)16(2)27)6-9-22(33-23)25(29)30/h7-8,12-14,22,28H,3-6,9-11H2,1-2H3,(H,29,30)