2-[3-(2-carboxyethyl)-4-methyl-2-oxidanylidene-chromen-7-yl]oxypropanoic acid

Systemtic Name: 2-[3-(2-carboxyethyl)-4-methyl-2-oxidanylidene-chromen-7-yl]oxypropanoic acid Openeye Name: 2-[3-(2-carboxyethyl)-4-methyl-2-oxo-chromen-7-yl]oxypropanoic acid CAS Name: 2-[[3-(2-carboxyethyl)-4-methyl-2-oxo-1-benzopyran-7-yl]oxy]propanoic acid IUPAC Name: 2-[3-(2-carboxyethyl)-4-methyl-2-oxochromen-7-yl]oxypropanoic acid Traditional Name: 2-[3-(2-carboxyethyl)-2-keto-4-methyl-chromen-7-yl]oxypropionic acid Formula: C16H16O7 MolecularWeight: 320.29404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(C)C(=O)O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC(C)C(=O)O)CCC(=O)O

InChI

InChI=1S/C16H16O7/c1-8-11-4-3-10(22-9(2)15(19)20)7-13(11)23-16(21)12(8)5-6-14(17)18/h3-4,7,9H,5-6H2,1-2H3,(H,17,18)(H,19,20)