sodium 2-ethylhexyl 4-ethyl-2-oxidanylidene-octanoate

Systemtic Name: sodium 2-ethylhexyl 4-ethyl-2-oxidanylidene-octanoate Openeye Name: sodium 2-ethylhexyl 4-ethyl-2-oxo-octanoate CAS Name: sodium 4-ethyl-2-oxooctanoic acid 2-ethylhexyl ester IUPAC Name: sodium 2-ethylhexyl 4-ethyl-2-oxooctanoate Traditional Name: sodium 4-ethyl-2-keto-caprylic acid 2-ethylhexyl ester Formula: C18H34NaO3+ MolecularWeight: 321.45053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(=O)C(=O)OCC(CC)CCCC.[Na+]

Isomeric SMILES

CCCCC(CC)CC(=O)C(=O)OCC(CC)CCCC.[Na+]

InChI

InChI=1S/C18H34O3.Na/c1-5-9-11-15(7-3)13-17(19)18(20)21-14-16(8-4)12-10-6-2;/h15-16H,5-14H2,1-4H3;/q;+1