2-ethanoylbenzoic acid; 3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one

Systemtic Name: 2-ethanoylbenzoic acid; 3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one Openeye Name: 2-acetylbenzoic acid; 3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one CAS Name: 2-acetylbenzoic acid; 3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one IUPAC Name: 2-acetylbenzoic acid; 3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one Traditional Name: 2-acetylbenzoic acid; 3-oxabicyclo[3.2.2]nona-1(7),5,8-trien-4-one Formula: C17H14O5 MolecularWeight: 298.29006

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1C(=O)O.C1C2=CC=C(C=C2)C(=O)O1

Isomeric SMILES

CC(=O)C1=CC=CC=C1C(=O)O.C1C2=CC=C(C=C2)C(=O)O1

InChI

InChI=1S/C9H8O3.C8H6O2/c1-6(10)7-4-2-3-5-8(7)9(11)12;9-8-7-3-1-6(2-4-7)5-10-8/h2-5H,1H3,(H,11,12);1-4H,5H2