2-[4-methyl-2-oxidanylidene-5-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-chromen-7-yl]oxypropanoic acid

Systemtic Name: 2-[4-methyl-2-oxidanylidene-5-(1-oxidanyl-1-oxidanylidene-propan-2-yl)oxy-chromen-7-yl]oxypropanoic acid Openeye Name: 2-[5-(2-hydroxy-1-methyl-2-oxo-ethoxy)-4-methyl-2-oxo-chromen-7-yl]oxypropanoic acid CAS Name: 2-[[5-(1-hydroxy-1-oxopropan-2-yl)oxy-4-methyl-2-oxo-1-benzopyran-7-yl]oxy]propanoic acid IUPAC Name: 2-[5-(1-hydroxy-1-oxopropan-2-yl)oxy-4-methyl-2-oxochromen-7-yl]oxypropanoic acid Traditional Name: 2-[5-(2-hydroxy-2-keto-1-methyl-ethoxy)-2-keto-4-methyl-chromen-7-yl]oxypropionic acid Formula: C16H16O8 MolecularWeight: 336.29344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=CC(=C12)OC(C)C(=O)O)OC(C)C(=O)O

Isomeric SMILES

CC1=CC(=O)OC2=CC(=CC(=C12)OC(C)C(=O)O)OC(C)C(=O)O

InChI

InChI=1S/C16H16O8/c1-7-4-13(17)24-12-6-10(22-8(2)15(18)19)5-11(14(7)12)23-9(3)16(20)21/h4-6,8-9H,1-3H3,(H,18,19)(H,20,21)