1-[6-bromanyl-3-(dodecoxymethoxy)-1-(2-hydroxyethyl)-5-methyl-5-oxidanylidene-1,5$l^{5}-azaphosphocan-1-ium-1-yl]hexadecan-2-one

Systemtic Name: 1-[6-bromanyl-3-(dodecoxymethoxy)-1-(2-hydroxyethyl)-5-methyl-5-oxidanylidene-1,5$l^{5}-azaphosphocan-1-ium-1-yl]hexadecan-2-one Openeye Name: 1-[6-bromo-3-(dodecoxymethoxy)-1-(2-hydroxyethyl)-5-methyl-5-oxo-1,5$l^{5}-azaphosphocan-1-ium-1-yl]hexadecan-2-one CAS Name: 1-[6-bromo-3-(dodecoxymethoxy)-1-(2-hydroxyethyl)-5-methyl-5-oxo-1,5$l^{5}-azaphosphocan-1-ium-1-yl]-2-hexadecanone IUPAC Name: 1-[6-bromo-3-(dodecoxymethoxy)-1-(2-hydroxyethyl)-5-methyl-5-oxo-1,5$l^{5}-azaphosphocan-1-ium-1-yl]hexadecan-2-one Traditional Name: 1-[6-bromo-1-(2-hydroxyethyl)-5-keto-3-(lauryloxymethoxy)-5-methyl-1,5$l^{5}-azaphosphocan-1-ium-1-yl]hexadecan-2-one Formula: C38H76BrNO5P+ MolecularWeight: 737.891501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)C[N+]1(CCC(P(=O)(CC(C1)OCOCCCCCCCCCCCC)C)Br)CCO

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)C[N+]1(CCC(P(=O)(CC(C1)OCOCCCCCCCCCCCC)C)Br)CCO

InChI

InChI=1S/C38H76BrNO5P/c1-4-6-8-10-12-14-16-17-18-20-22-24-26-36(42)32-40(29-30-41)28-27-38(39)46(3,43)34-37(33-40)45-35-44-31-25-23-21-19-15-13-11-9-7-5-2/h37-38,41H,4-35H2,1-3H3/q+1