8-[(1S,2R)-2-[(E)-7-ethoxy-7-oxidanylidene-hept-5-enyl]-3-oxidanylidene-cyclopentyl]octyl benzoate

Systemtic Name: 8-[(1S,2R)-2-[(E)-7-ethoxy-7-oxidanylidene-hept-5-enyl]-3-oxidanylidene-cyclopentyl]octyl benzoate Openeye Name: 8-[(1S,2R)-2-[(E)-7-ethoxy-7-oxo-hept-5-enyl]-3-oxo-cyclopentyl]octyl benzoate CAS Name: benzoic acid 8-[(1S,2R)-2-[(E)-7-ethoxy-7-oxohept-5-enyl]-3-oxocyclopentyl]octyl ester IUPAC Name: 8-[(1S,2R)-2-[(E)-7-ethoxy-7-oxohept-5-enyl]-3-oxocyclopentyl]octyl benzoate Traditional Name: benzoic acid 8-[(1S,2R)-2-[(E)-7-ethoxy-7-keto-hept-5-enyl]-3-keto-cyclopentyl]octyl ester Formula: C29H42O5 MolecularWeight: 470.64078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCCCC1C(CCC1=O)CCCCCCCCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/CCCC[C@@H]1[C@H](CCC1=O)CCCCCCCCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C29H42O5/c1-2-33-28(31)20-14-7-6-13-19-26-24(21-22-27(26)30)16-10-5-3-4-8-15-23-34-29(32)25-17-11-9-12-18-25/h9,11-12,14,17-18,20,24,26H,2-8,10,13,15-16,19,21-23H2,1H3/b20-14+/t24-,26+/m0/s1