trimethyl-[(2R)-2-octanoyloxy-4-oxidanylidene-4-tridecoxy-butyl]azanium

Systemtic Name: trimethyl-[(2R)-2-octanoyloxy-4-oxidanylidene-4-tridecoxy-butyl]azanium Openeye Name: trimethyl-[(2R)-2-octanoyloxy-4-oxo-4-tridecoxy-butyl]ammonium CAS Name: trimethyl-[(2R)-4-oxo-2-(1-oxooctoxy)-4-tridecoxybutyl]ammonium IUPAC Name: trimethyl-[(2R)-2-octanoyloxy-4-oxo-4-tridecoxybutyl]azanium Traditional Name: [(2R)-2-caprylyloxy-4-keto-4-tridecoxy-butyl]-trimethyl-ammonium Formula: C28H56NO4+ MolecularWeight: 470.74854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)CC(C[N+](C)(C)C)OC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C[C@H](C[N+](C)(C)C)OC(=O)CCCCCCC

InChI

InChI=1S/C28H56NO4/c1-6-8-10-12-13-14-15-16-17-19-21-23-32-28(31)24-26(25-29(3,4)5)33-27(30)22-20-18-11-9-7-2/h26H,6-25H2,1-5H3/q+1/t26-/m1/s1