3-(3-butoxy-2-oxidanyl-4-oxidanylidene-chromen-8-yl)oxypropanoic acid

Systemtic Name: 3-(3-butoxy-2-oxidanyl-4-oxidanylidene-chromen-8-yl)oxypropanoic acid Openeye Name: 3-(3-butoxy-2-hydroxy-4-oxo-chromen-8-yl)oxypropanoic acid CAS Name: 3-[(3-butoxy-2-hydroxy-4-oxo-1-benzopyran-8-yl)oxy]propanoic acid IUPAC Name: 3-(3-butoxy-2-hydroxy-4-oxochromen-8-yl)oxypropanoic acid Traditional Name: 3-(3-butoxy-2-hydroxy-4-keto-chromen-8-yl)oxypropionic acid Formula: C16H18O7 MolecularWeight: 322.30992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(OC2=C(C1=O)C=CC=C2OCCC(=O)O)O

Isomeric SMILES

CCCCOC1=C(OC2=C(C1=O)C=CC=C2OCCC(=O)O)O

InChI

InChI=1S/C16H18O7/c1-2-3-8-22-15-13(19)10-5-4-6-11(14(10)23-16(15)20)21-9-7-12(17)18/h4-6,20H,2-3,7-9H2,1H3,(H,17,18)