6-hexadecanoyloxyhexylazanium; N-(6-hexadecanoyloxyhexyl)carbamate

Systemtic Name: 6-hexadecanoyloxyhexylazanium; N-(6-hexadecanoyloxyhexyl)carbamate Openeye Name: 6-hexadecanoyloxyhexylammonium; N-(6-hexadecanoyloxyhexyl)carbamate CAS Name: 6-(1-oxohexadecoxy)hexylammonium; N-[6-(1-oxohexadecoxy)hexyl]carbamate IUPAC Name: 6-hexadecanoyloxyhexylazanium; N-(6-hexadecanoyloxyhexyl)carbamate Traditional Name: 6-hexadecanoyloxyhexylammonium; N-(6-hexadecanoyloxyhexyl)carbamate Formula: C45H90N2O6 MolecularWeight: 755.2059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCCCCCC[NH3+].CCCCCCCCCCCCCCCC(=O)OCCCCCCNC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCCCCCC[NH3+].CCCCCCCCCCCCCCCC(=O)OCCCCCCNC(=O)[O-]

InChI

InChI=1S/C23H45NO4.C22H45NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-22(25)28-21-18-15-14-17-20-24-23(26)27;1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-22(24)25-21-18-15-14-17-20-23/h24H,2-21H2,1H3,(H,26,27);2-21,23H2,1H3