3-azaniumylpropyl-[2-[2,3-di(tetradecanoyloxy)propoxy]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 3-azaniumylpropyl-[2-[2,3-di(tetradecanoyloxy)propoxy]-2-oxidanylidene-ethyl]azanium Openeye Name: 3-azaniumylpropyl-[2-[2,3-di(tetradecanoyloxy)propoxy]-2-oxo-ethyl]ammonium CAS Name: 3-ammoniopropyl-[2-[2,3-bis(1-oxotetradecoxy)propoxy]-2-oxoethyl]ammonium IUPAC Name: 3-azaniumylpropyl-[2-[2,3-di(tetradecanoyloxy)propoxy]-2-oxoethyl]azanium Traditional Name: 3-ammoniopropyl-[2-[2,3-di(tetradecanoyloxy)propoxy]-2-keto-ethyl]ammonium Formula: C36H72N2O6+2 MolecularWeight: 628.96668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(COC(=O)C[NH2+]CCC[NH3+])OC(=O)CCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COC(=O)C[NH2+]CCC[NH3+])OC(=O)CCCCCCCCCCCCC

InChI

InChI=1S/C36H70N2O6/c1-3-5-7-9-11-13-15-17-19-21-23-26-34(39)42-31-33(32-43-36(41)30-38-29-25-28-37)44-35(40)27-24-22-20-18-16-14-12-10-8-6-4-2/h33,38H,3-32,37H2,1-2H3/p+2