[(E,2S)-7-methoxy-2-oxidanyl-4,7-bis(oxidanylidene)hept-5-enyl] benzoate

Systemtic Name: [(E,2S)-7-methoxy-2-oxidanyl-4,7-bis(oxidanylidene)hept-5-enyl] benzoate Openeye Name: [(E,2S)-2-hydroxy-7-methoxy-4,7-dioxo-hept-5-enyl] benzoate CAS Name: benzoic acid [(E,2S)-2-hydroxy-7-methoxy-4,7-dioxohept-5-enyl] ester IUPAC Name: [(E,2S)-2-hydroxy-7-methoxy-4,7-dioxohept-5-enyl] benzoate Traditional Name: benzoic acid [(E,2S)-2-hydroxy-4,7-diketo-7-methoxy-hept-5-enyl] ester Formula: C15H16O6 MolecularWeight: 292.28394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)/C=C/C(=O)C[C@@H](COC(=O)C1=CC=CC=C1)O

InChI

InChI=1S/C15H16O6/c1-20-14(18)8-7-12(16)9-13(17)10-21-15(19)11-5-3-2-4-6-11/h2-8,13,17H,9-10H2,1H3/b8-7+/t13-/m0/s1