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

Systemtic Name: 4-[3-[(E)-but-1-enoxy]-2-oxidanyl-4-oxidanylidene-chromen-5-yl]oxybutanoic acid Openeye Name: 4-[3-[(E)-but-1-enoxy]-2-hydroxy-4-oxo-chromen-5-yl]oxybutanoic acid CAS Name: 4-[[3-[(E)-but-1-enoxy]-2-hydroxy-4-oxo-1-benzopyran-5-yl]oxy]butanoic acid IUPAC Name: 4-[3-[(E)-but-1-enoxy]-2-hydroxy-4-oxochromen-5-yl]oxybutanoic acid Traditional Name: 4-[3-[(E)-but-1-enoxy]-2-hydroxy-4-keto-chromen-5-yl]oxybutyric acid Formula: C17H18O7 MolecularWeight: 334.32062

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Descriptors Computed from Structure

Canonical SMILES:

CCC=COC1=C(OC2=C(C1=O)C(=CC=C2)OCCCC(=O)O)O

Isomeric SMILES

CC/C=C/OC1=C(OC2=C(C1=O)C(=CC=C2)OCCCC(=O)O)O

InChI

InChI=1S/C17H18O7/c1-2-3-9-23-16-15(20)14-11(22-10-5-8-13(18)19)6-4-7-12(14)24-17(16)21/h3-4,6-7,9,21H,2,5,8,10H2,1H3,(H,18,19)/b9-3+