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

Systemtic Name: 3-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 3-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]chromane-2-carboxylic acid CAS Name: 3-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 3-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 3-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]chroman-2-carboxylic acid Formula: C26H32O7 MolecularWeight: 456.52808

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2CC3=CC=CC=C3OC2C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2CC3=CC=CC=C3OC2C(=O)O

InChI

InChI=1S/C26H32O7/c1-3-9-20-22(13-12-19(17(2)27)24(20)28)31-14-7-4-8-15-32-23-16-18-10-5-6-11-21(18)33-25(23)26(29)30/h5-6,10-13,23,25,28H,3-4,7-9,14-16H2,1-2H3,(H,29,30)