methyl 4-[2-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]ethyl]benzoate

Systemtic Name: methyl 4-[2-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]ethyl]benzoate Openeye Name: methyl 4-[2-(3,6-dioxocyclohexa-1,4-dien-1-yl)ethyl]benzoate CAS Name: 4-[2-(3,6-dioxo-1-cyclohexa-1,4-dienyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(3,6-dioxocyclohexa-1,4-dien-1-yl)ethyl]benzoate Traditional Name: 4-[2-(3,6-diketocyclohexa-1,4-dien-1-yl)ethyl]benzoic acid methyl ester Formula: C16H14O4 MolecularWeight: 270.27996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCC2=CC(=O)C=CC2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCC2=CC(=O)C=CC2=O

InChI

InChI=1S/C16H14O4/c1-20-16(19)12-5-2-11(3-6-12)4-7-13-10-14(17)8-9-15(13)18/h2-3,5-6,8-10H,4,7H2,1H3