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

Systemtic Name: 7-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-6-(phenylcarbonyl)-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 7-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]-6-benzoyl-chromane-2-carboxylic acid CAS Name: 7-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-6-benzoyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-6-benzoyl-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 7-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]-6-benzoyl-chroman-2-carboxylic acid Formula: C33H36O8 MolecularWeight: 560.63414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=CC3=C(CCC(O3)C(=O)O)C=C2C(=O)C4=CC=CC=C4

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=CC3=C(CCC(O3)C(=O)O)C=C2C(=O)C4=CC=CC=C4

InChI

InChI=1S/C33H36O8/c1-3-10-25-27(16-14-24(21(2)34)32(25)36)39-17-8-5-9-18-40-30-20-29-23(13-15-28(41-29)33(37)38)19-26(30)31(35)22-11-6-4-7-12-22/h4,6-7,11-12,14,16,19-20,28,36H,3,5,8-10,13,15,17-18H2,1-2H3,(H,37,38)