1,2-dimethylxanthen-9-one; ethanoic acid

Systemtic Name: 1,2-dimethylxanthen-9-one; ethanoic acid Openeye Name: acetic acid; 1,2-dimethylxanthen-9-one CAS Name: acetic acid; 1,2-dimethyl-9-xanthenone IUPAC Name: acetic acid; 1,2-dimethylxanthen-9-one Traditional Name: acetic acid; 1,2-dimethylxanthone Formula: C17H16O4 MolecularWeight: 284.30654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)OC3=CC=CC=C3C2=O)C.CC(=O)O

Isomeric SMILES

CC1=C(C2=C(C=C1)OC3=CC=CC=C3C2=O)C.CC(=O)O

InChI

InChI=1S/C15H12O2.C2H4O2/c1-9-7-8-13-14(10(9)2)15(16)11-5-3-4-6-12(11)17-13;1-2(3)4/h3-8H,1-2H3;1H3,(H,3,4)