[(5S,6E,8E)-1-ethoxy-1,10-bis(oxidanylidene)deca-6,8-dien-5-yl] benzoate

Systemtic Name: [(5S,6E,8E)-1-ethoxy-1,10-bis(oxidanylidene)deca-6,8-dien-5-yl] benzoate Openeye Name: [(1S,2E,4E)-1-(4-ethoxy-4-oxo-butyl)-6-oxo-hexa-2,4-dienyl] benzoate CAS Name: benzoic acid [(5S,6E,8E)-1-ethoxy-1,10-dioxodeca-6,8-dien-5-yl] ester IUPAC Name: [(5S,6E,8E)-1-ethoxy-1,10-dioxodeca-6,8-dien-5-yl] benzoate Traditional Name: benzoic acid [(1S,2E,4E)-1-(4-ethoxy-4-keto-butyl)-6-keto-hexa-2,4-dienyl] ester Formula: C19H22O5 MolecularWeight: 330.37498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC(C=CC=CC=O)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CCC[C@@H](/C=C/C=C/C=O)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C19H22O5/c1-2-23-18(21)14-9-13-17(12-7-4-8-15-20)24-19(22)16-10-5-3-6-11-16/h3-8,10-12,15,17H,2,9,13-14H2,1H3/b8-4+,12-7+/t17-/m1/s1