3-[2-(4-methoxy-4-oxidanylidene-butoxy)-6-[6-(4-oxidanylidene-8-prop-2-enyl-chromen-7-yl)oxyhexyl]phenyl]propanoic acid

Systemtic Name: 3-[2-(4-methoxy-4-oxidanylidene-butoxy)-6-[6-(4-oxidanylidene-8-prop-2-enyl-chromen-7-yl)oxyhexyl]phenyl]propanoic acid Openeye Name: 3-[2-[6-(8-allyl-4-oxo-chromen-7-yl)oxyhexyl]-6-(4-methoxy-4-oxo-butoxy)phenyl]propanoic acid CAS Name: 3-[2-(4-methoxy-4-oxobutoxy)-6-[6-[(4-oxo-8-prop-2-enyl-1-benzopyran-7-yl)oxy]hexyl]phenyl]propanoic acid IUPAC Name: 3-[2-(4-methoxy-4-oxobutoxy)-6-[6-(4-oxo-8-prop-2-enylchromen-7-yl)oxyhexyl]phenyl]propanoic acid Traditional Name: 3-[2-[6-(8-allyl-4-keto-chromen-7-yl)oxyhexyl]-6-(4-keto-4-methoxy-butoxy)phenyl]propionic acid Formula: C32H38O8 MolecularWeight: 550.63932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=CC=CC(=C1CCC(=O)O)CCCCCCOC2=C(C3=C(C=C2)C(=O)C=CO3)CC=C

Isomeric SMILES

COC(=O)CCCOC1=CC=CC(=C1CCC(=O)O)CCCCCCOC2=C(C3=C(C=C2)C(=O)C=CO3)CC=C

InChI

InChI=1S/C32H38O8/c1-3-10-26-29(17-15-25-27(33)19-22-40-32(25)26)38-20-7-5-4-6-11-23-12-8-13-28(24(23)16-18-30(34)35)39-21-9-14-31(36)37-2/h3,8,12-13,15,17,19,22H,1,4-7,9-11,14,16,18,20-21H2,2H3,(H,34,35)