16-methyl-N-[1-(16-methylheptadecanoylamino)-1-(2-methyloxiran-1-ium-1-yl)propyl]heptadecanamide chloride

Systemtic Name: 16-methyl-N-[1-(16-methylheptadecanoylamino)-1-(2-methyloxiran-1-ium-1-yl)propyl]heptadecanamide chloride Openeye Name: 16-methyl-N-[1-(16-methylheptadecanoylamino)-1-(2-methyloxiran-1-ium-1-yl)propyl]heptadecanamide chloride CAS Name: 16-methyl-N-[1-(2-methyl-1-oxiran-1-iumyl)-1-[(16-methyl-1-oxoheptadecyl)amino]propyl]heptadecanamide chloride IUPAC Name: 16-methyl-N-[1-(16-methylheptadecanoylamino)-1-(2-methyloxiran-1-ium-1-yl)propyl]heptadecanamide chloride Traditional Name: 16-methyl-N-[1-(16-methylheptadecanoylamino)-1-(2-methyloxiran-1-ium-1-yl)propyl]heptadecanamide chloride Formula: C42H83ClN2O3 MolecularWeight: 699.57302

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)CCCCCCCCCCCCCCC(C)C)(NC(=O)CCCCCCCCCCCCCCC(C)C)[O+]1CC1C.[Cl-]

Isomeric SMILES

CCC(NC(=O)CCCCCCCCCCCCCCC(C)C)(NC(=O)CCCCCCCCCCCCCCC(C)C)[O+]1CC1C.[Cl-]

InChI

InChI=1S/C42H82N2O3.ClH/c1-7-42(47-36-39(47)6,43-40(45)34-30-26-22-18-14-10-8-12-16-20-24-28-32-37(2)3)44-41(46)35-31-27-23-19-15-11-9-13-17-21-25-29-33-38(4)5;/h37-39H,7-36H2,1-6H3,(H-,43,44,45,46);1H