2-(4-methyl-9-oxidanylidene-xanthen-3-yl)oxyethanoic acid

Systemtic Name: 2-(4-methyl-9-oxidanylidene-xanthen-3-yl)oxyethanoic acid Openeye Name: 2-(4-methyl-9-oxo-xanthen-3-yl)oxyacetic acid CAS Name: 2-[(4-methyl-9-oxo-3-xanthenyl)oxy]acetic acid IUPAC Name: 2-(4-methyl-9-oxoxanthen-3-yl)oxyacetic acid Traditional Name: 2-(9-keto-4-methyl-xanthen-3-yl)oxyacetic acid Formula: C16H12O5 MolecularWeight: 284.26348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC3=CC=CC=C3C2=O)OCC(=O)O

InChI

InChI=1S/C16H12O5/c1-9-12(20-8-14(17)18)7-6-11-15(19)10-4-2-3-5-13(10)21-16(9)11/h2-7H,8H2,1H3,(H,17,18)