2-(6-methyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxypropanoic acid

Systemtic Name: 2-(6-methyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxypropanoic acid Openeye Name: 2-(1-hydroxy-6-methyl-9-oxo-xanthen-3-yl)oxypropanoic acid CAS Name: 2-[(1-hydroxy-6-methyl-9-oxo-3-xanthenyl)oxy]propanoic acid IUPAC Name: 2-(1-hydroxy-6-methyl-9-oxoxanthen-3-yl)oxypropanoic acid Traditional Name: 2-(1-hydroxy-9-keto-6-methyl-xanthen-3-yl)oxypropionic acid Formula: C17H14O6 MolecularWeight: 314.28946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C3=C(C=C(C=C3O2)OC(C)C(=O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C3=C(C=C(C=C3O2)OC(C)C(=O)O)O

InChI

InChI=1S/C17H14O6/c1-8-3-4-11-13(5-8)23-14-7-10(22-9(2)17(20)21)6-12(18)15(14)16(11)19/h3-7,9,18H,1-2H3,(H,20,21)