2-[3-(2-carboxyethyl)-4,8-dimethyl-2-oxidanylidene-chromen-7-yl]oxypropanoic acid

Systemtic Name: 2-[3-(2-carboxyethyl)-4,8-dimethyl-2-oxidanylidene-chromen-7-yl]oxypropanoic acid Openeye Name: 2-[3-(2-carboxyethyl)-4,8-dimethyl-2-oxo-chromen-7-yl]oxypropanoic acid CAS Name: 2-[[3-(2-carboxyethyl)-4,8-dimethyl-2-oxo-1-benzopyran-7-yl]oxy]propanoic acid IUPAC Name: 2-[3-(2-carboxyethyl)-4,8-dimethyl-2-oxochromen-7-yl]oxypropanoic acid Traditional Name: 2-[3-(2-carboxyethyl)-2-keto-4,8-dimethyl-chromen-7-yl]oxypropionic acid Formula: C17H18O7 MolecularWeight: 334.32062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)O)CCC(=O)O

InChI

InChI=1S/C17H18O7/c1-8-11-4-6-13(23-10(3)16(20)21)9(2)15(11)24-17(22)12(8)5-7-14(18)19/h4,6,10H,5,7H2,1-3H3,(H,18,19)(H,20,21)