ethyl (3E)-3-[methoxy(oxidanyl)methylidene]-13-oxidanyl-2-oxidanylidene-nonadec-10-enoate

Systemtic Name: ethyl (3E)-3-[methoxy(oxidanyl)methylidene]-13-oxidanyl-2-oxidanylidene-nonadec-10-enoate Openeye Name: ethyl (3E)-13-hydroxy-3-[hydroxy(methoxy)methylene]-2-oxo-nonadec-10-enoate CAS Name: (3E)-13-hydroxy-3-[hydroxy(methoxy)methylidene]-2-oxo-10-nonadecenoic acid ethyl ester IUPAC Name: ethyl (3E)-13-hydroxy-3-[hydroxy(methoxy)methylidene]-2-oxononadec-10-enoate Traditional Name: (3E)-13-hydroxy-3-[hydroxy(methoxy)methylene]-2-keto-nonadec-10-enoic acid ethyl ester Formula: C23H40O6 MolecularWeight: 412.5601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCC(=C(O)OC)C(=O)C(=O)OCC)O

Isomeric SMILES

CCCCCCC(CC=CCCCCCC/C(=C(/O)\OC)/C(=O)C(=O)OCC)O

InChI

InChI=1S/C23H40O6/c1-4-6-7-13-16-19(24)17-14-11-9-8-10-12-15-18-20(22(26)28-3)21(25)23(27)29-5-2/h11,14,19,24,26H,4-10,12-13,15-18H2,1-3H3/b14-11?,22-20+