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

Systemtic Name: 2-(6-methyl-1-oxidanyl-9-oxidanylidene-xanthen-3-yl)oxyethanoic acid Openeye Name: 2-(1-hydroxy-6-methyl-9-oxo-xanthen-3-yl)oxyacetic acid CAS Name: 2-[(1-hydroxy-6-methyl-9-oxo-3-xanthenyl)oxy]acetic acid IUPAC Name: 2-(1-hydroxy-6-methyl-9-oxoxanthen-3-yl)oxyacetic acid Traditional Name: 2-(1-hydroxy-9-keto-6-methyl-xanthen-3-yl)oxyacetic acid Formula: C16H12O6 MolecularWeight: 300.26288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12O6/c1-8-2-3-10-12(4-8)22-13-6-9(21-7-14(18)19)5-11(17)15(13)16(10)20/h2-6,17H,7H2,1H3,(H,18,19)