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calcium 3-(2-ethylhexylcarbamoyloxycarbonyl)hexanoate

calcium 3-(2-ethylhexylcarbamoyloxycarbonyl)hexanoate

Systemtic Name:calcium 3-(2-ethylhexylcarbamoyloxycarbonyl)hexanoate
Openeye Name:calcium 3-(2-ethylhexylcarbamoyloxycarbonyl)hexanoate
CAS Name:calcium 3-[[(2-ethylhexylamino)-oxomethoxy]-oxomethyl]hexanoate
IUPAC Name:calcium 3-(2-ethylhexylcarbamoyloxycarbonyl)hexanoate
Traditional Name:calcium 3-(2-ethylhexylcarbamoyloxycarbonyl)hexanoate
Formula: C16H28CaNO5+
MolecularWeight: 354.47522
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)OC(=O)C(CCC)CC(=O)[O-].[Ca+2]


Isomeric SMILES

CCCCC(CC)CNC(=O)OC(=O)C(CCC)CC(=O)[O-].[Ca+2]


InChI

InChI=1S/C16H29NO5.Ca/c1-4-7-9-12(6-3)11-17-16(21)22-15(20)13(8-5-2)10-14(18)19;/h12-13H,4-11H2,1-3H3,(H,17,21)(H,18,19);/q;+2/p-1


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