3-[3-[(E)-oct-1-enoxy]-2-oxidanyl-4-oxidanylidene-chromen-5-yl]oxypropanoic acid

Systemtic Name: 3-[3-[(E)-oct-1-enoxy]-2-oxidanyl-4-oxidanylidene-chromen-5-yl]oxypropanoic acid Openeye Name: 3-[2-hydroxy-3-[(E)-oct-1-enoxy]-4-oxo-chromen-5-yl]oxypropanoic acid CAS Name: 3-[[2-hydroxy-3-[(E)-oct-1-enoxy]-4-oxo-1-benzopyran-5-yl]oxy]propanoic acid IUPAC Name: 3-[2-hydroxy-3-[(E)-oct-1-enoxy]-4-oxochromen-5-yl]oxypropanoic acid Traditional Name: 3-[2-hydroxy-4-keto-3-[(E)-oct-1-enoxy]chromen-5-yl]oxypropionic acid Formula: C20H24O7 MolecularWeight: 376.40036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=COC1=C(OC2=C(C1=O)C(=CC=C2)OCCC(=O)O)O

Isomeric SMILES

CCCCCC/C=C/OC1=C(OC2=C(C1=O)C(=CC=C2)OCCC(=O)O)O

InChI

InChI=1S/C20H24O7/c1-2-3-4-5-6-7-12-26-19-18(23)17-14(25-13-11-16(21)22)9-8-10-15(17)27-20(19)24/h7-10,12,24H,2-6,11,13H2,1H3,(H,21,22)/b12-7+