2-[5-(4-acetyloxyphenyl)-6-(2-oxidanidyl-2-oxidanylidene-ethyl)cyclohexa-2,4-dien-1-yl]ethanoate

Systemtic Name: 2-[5-(4-acetyloxyphenyl)-6-(2-oxidanidyl-2-oxidanylidene-ethyl)cyclohexa-2,4-dien-1-yl]ethanoate Openeye Name: 2-[5-(4-acetoxyphenyl)-6-(2-oxido-2-oxo-ethyl)cyclohexa-2,4-dien-1-yl]acetate CAS Name: 2-[5-(4-acetyloxyphenyl)-6-(2-oxido-2-oxoethyl)-1-cyclohexa-2,4-dienyl]acetate IUPAC Name: 2-[5-(4-acetyloxyphenyl)-6-(2-oxido-2-oxoethyl)cyclohexa-2,4-dien-1-yl]acetate Traditional Name: 2-[5-(4-acetoxyphenyl)-6-(2-keto-2-oxido-ethyl)cyclohexa-2,4-dien-1-yl]acetate Formula: C18H16O6-2 MolecularWeight: 328.31604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=CC=CC(C2CC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=CC=CC(C2CC(=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C18H18O6/c1-11(19)24-14-7-5-12(6-8-14)15-4-2-3-13(9-17(20)21)16(15)10-18(22)23/h2-8,13,16H,9-10H2,1H3,(H,20,21)(H,22,23)/p-2