dimethyl-[1-(octadecanoylamino)ethyl]-oxidanyl-azanium; 2-oxidanylpropanoate

Systemtic Name: dimethyl-[1-(octadecanoylamino)ethyl]-oxidanyl-azanium; 2-oxidanylpropanoate Openeye Name: hydroxy-dimethyl-[1-(octadecanoylamino)ethyl]ammonium; 2-hydroxypropanoate CAS Name: hydroxy-dimethyl-[1-(1-oxooctadecylamino)ethyl]ammonium; 2-hydroxypropanoate IUPAC Name: hydroxy-dimethyl-[1-(octadecanoylamino)ethyl]azanium; 2-hydroxypropanoate Traditional Name: hydroxy-dimethyl-(1-stearamidoethyl)ammonium; lactate Formula: C25H52N2O5 MolecularWeight: 460.69078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(C)[N+](C)(C)O.CC(C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(C)[N+](C)(C)O.CC(C(=O)[O-])O

InChI

InChI=1S/C22H46N2O2.C3H6O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(25)23-21(2)24(3,4)26;1-2(4)3(5)6/h21,26H,5-20H2,1-4H3;2,4H,1H3,(H,5,6)