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

Systemtic Name: 6-ethanoyl-7-[5-(4-methanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 6-acetyl-7-[5-(4-formyl-3-hydroxy-2-propyl-phenoxy)pentoxy]chromane-2-carboxylic acid CAS Name: 6-acetyl-7-[5-(4-formyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 6-acetyl-7-[5-(4-formyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 6-acetyl-7-[5-(4-formyl-3-hydroxy-2-propyl-phenoxy)pentoxy]chroman-2-carboxylic acid Formula: C27H32O8 MolecularWeight: 484.53818

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C=O)OCCCCCOC2=CC3=C(CCC(O3)C(=O)O)C=C2C(=O)C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C=O)OCCCCCOC2=CC3=C(CCC(O3)C(=O)O)C=C2C(=O)C

InChI

InChI=1S/C27H32O8/c1-3-7-20-22(10-9-19(16-28)26(20)30)33-12-5-4-6-13-34-25-15-24-18(14-21(25)17(2)29)8-11-23(35-24)27(31)32/h9-10,14-16,23,30H,3-8,11-13H2,1-2H3,(H,31,32)