[(2E,4R,6Z)-11-methoxy-1,11-bis(oxidanylidene)undeca-2,6-dien-4-yl] benzoate

Systemtic Name: [(2E,4R,6Z)-11-methoxy-1,11-bis(oxidanylidene)undeca-2,6-dien-4-yl] benzoate Openeye Name: [(Z,1R)-8-methoxy-8-oxo-1-[(E)-3-oxoprop-1-enyl]oct-3-enyl] benzoate CAS Name: benzoic acid [(2E,4R,6Z)-11-methoxy-1,11-dioxoundeca-2,6-dien-4-yl] ester IUPAC Name: [(2E,4R,6Z)-11-methoxy-1,11-dioxoundeca-2,6-dien-4-yl] benzoate Traditional Name: benzoic acid [(Z,1R)-8-keto-1-[(E)-3-ketoprop-1-enyl]-8-methoxy-oct-3-enyl] ester Formula: C19H22O5 MolecularWeight: 330.37498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=CCC(C=CC=O)OC(=O)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C19H22O5/c1-23-18(21)14-8-3-2-7-12-17(13-9-15-20)24-19(22)16-10-5-4-6-11-16/h2,4-7,9-11,13,15,17H,3,8,12,14H2,1H3/b7-2-,13-9+/t17-/m1/s1