bis(2-oxidanylpropyl)-(phenylmethyl)-tetradecyl-azanium

Systemtic Name: bis(2-oxidanylpropyl)-(phenylmethyl)-tetradecyl-azanium Openeye Name: benzyl-bis(2-hydroxypropyl)-tetradecyl-ammonium CAS Name: bis(2-hydroxypropyl)-(phenylmethyl)-tetradecylammonium IUPAC Name: benzyl-bis(2-hydroxypropyl)-tetradecylazanium Traditional Name: benzyl-bis(2-hydroxypropyl)-myristyl-ammonium Formula: C27H50NO2+ MolecularWeight: 420.6914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](CC1=CC=CC=C1)(CC(C)O)CC(C)O

Isomeric SMILES

CCCCCCCCCCCCCC[N+](CC1=CC=CC=C1)(CC(C)O)CC(C)O

InChI

InChI=1S/C27H50NO2/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-28(22-25(2)29,23-26(3)30)24-27-19-16-15-17-20-27/h15-17,19-20,25-26,29-30H,4-14,18,21-24H2,1-3H3/q+1