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

Systemtic Name: ethyl (E,3E)-3-[methoxy(oxidanyl)methylidene]-13-oxidanyl-2-oxidanylidene-nonadec-10-enoate; sodium Openeye Name: ethyl (E,3E)-13-hydroxy-3-[hydroxy(methoxy)methylene]-2-oxo-nonadec-10-enoate; sodium CAS Name: (E,3E)-13-hydroxy-3-[hydroxy(methoxy)methylidene]-2-oxo-10-nonadecenoic acid ethyl ester; sodium IUPAC Name: ethyl (E,3E)-13-hydroxy-3-[hydroxy(methoxy)methylidene]-2-oxononadec-10-enoate; sodium Traditional Name: (E,3E)-13-hydroxy-3-[hydroxy(methoxy)methylene]-2-keto-nonadec-10-enoic acid ethyl ester; sodium Formula: C23H40NaO6 MolecularWeight: 435.54987

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCC(=C(O)OC)C(=O)C(=O)OCC)O.[Na]

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCC/C(=C(/O)\OC)/C(=O)C(=O)OCC)O.[Na]

InChI

InChI=1S/C23H40O6.Na/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+;