7-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-3,4-bis(oxidanyl)-8-propyl-2H-chromene-2-carboxylic acid

Systemtic Name: 7-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-3,4-bis(oxidanyl)-8-propyl-2H-chromene-2-carboxylic acid Openeye Name: 7-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]-3,4-dihydroxy-8-propyl-2H-chromene-2-carboxylic acid CAS Name: 7-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydroxy-8-propyl-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydroxy-8-propyl-2H-chromene-2-carboxylic acid Traditional Name: 7-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]-3,4-dihydroxy-8-propyl-2H-chromene-2-carboxylic acid Formula: C29H36O9 MolecularWeight: 528.59074

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=C(C3=C(C=C2)C(=C(C(O3)C(=O)O)O)O)CCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=C(C3=C(C=C2)C(=C(C(O3)C(=O)O)O)O)CCC

InChI

InChI=1S/C29H36O9/c1-4-9-19-22(13-11-18(17(3)30)24(19)31)36-15-7-6-8-16-37-23-14-12-21-25(32)26(33)28(29(34)35)38-27(21)20(23)10-5-2/h11-14,28,31-33H,4-10,15-16H2,1-3H3,(H,34,35)