2-(5,6-dimethyl-9-oxidanylidene-xanthen-4-yl)ethanoate

Systemtic Name: 2-(5,6-dimethyl-9-oxidanylidene-xanthen-4-yl)ethanoate Openeye Name: 2-(5,6-dimethyl-9-oxo-xanthen-4-yl)acetate CAS Name: 2-(5,6-dimethyl-9-oxo-4-xanthenyl)acetate IUPAC Name: 2-(5,6-dimethyl-9-oxoxanthen-4-yl)acetate Traditional Name: 2-(9-keto-5,6-dimethyl-xanthen-4-yl)acetate Formula: C17H13O4- MolecularWeight: 281.28272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)C3=C(O2)C(=CC=C3)CC(=O)[O-])C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)C3=C(O2)C(=CC=C3)CC(=O)[O-])C

InChI

InChI=1S/C17H14O4/c1-9-6-7-13-15(20)12-5-3-4-11(8-14(18)19)17(12)21-16(13)10(9)2/h3-7H,8H2,1-2H3,(H,18,19)/p-1