methyl 4-acetyloxy-1-[5-methoxy-3,5-bis(oxidanylidene)pentyl]cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: methyl 4-acetyloxy-1-[5-methoxy-3,5-bis(oxidanylidene)pentyl]cyclohexa-2,5-diene-1-carboxylate Openeye Name: methyl 4-acetoxy-1-(5-methoxy-3,5-dioxo-pentyl)cyclohexa-2,5-diene-1-carboxylate CAS Name: 4-acetyloxy-1-(5-methoxy-3,5-dioxopentyl)-1-cyclohexa-2,5-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-acetyloxy-1-(5-methoxy-3,5-dioxopentyl)cyclohexa-2,5-diene-1-carboxylate Traditional Name: 4-acetoxy-1-(3,5-diketo-5-methoxy-pentyl)cyclohexa-2,5-diene-1-carboxylic acid methyl ester Formula: C16H20O7 MolecularWeight: 324.3258

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CC(C=C1)(CCC(=O)CC(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)OC1C=CC(C=C1)(CCC(=O)CC(=O)OC)C(=O)OC

InChI

InChI=1S/C16H20O7/c1-11(17)23-13-5-8-16(9-6-13,15(20)22-3)7-4-12(18)10-14(19)21-2/h5-6,8-9,13H,4,7,10H2,1-3H3