[2-[dodecyl(tetradecyl)amino]-2-oxidanylidene-ethyl]-tris(prop-2-enyl)azanium

Systemtic Name: [2-[dodecyl(tetradecyl)amino]-2-oxidanylidene-ethyl]-tris(prop-2-enyl)azanium Openeye Name: triallyl-[2-[dodecyl(tetradecyl)amino]-2-oxo-ethyl]ammonium CAS Name: [2-[dodecyl(tetradecyl)amino]-2-oxoethyl]-tris(prop-2-enyl)ammonium IUPAC Name: [2-[dodecyl(tetradecyl)amino]-2-oxoethyl]-tris(prop-2-enyl)azanium Traditional Name: triallyl-[2-keto-2-[lauryl(myristyl)amino]ethyl]ammonium Formula: C37H71N2O+ MolecularWeight: 559.97244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCN(CCCCCCCCCCCC)C(=O)C[N+](CC=C)(CC=C)CC=C

Isomeric SMILES

CCCCCCCCCCCCCCN(CCCCCCCCCCCC)C(=O)C[N+](CC=C)(CC=C)CC=C

InChI

InChI=1S/C37H71N2O/c1-6-11-13-15-17-19-21-22-24-26-28-30-32-38(31-29-27-25-23-20-18-16-14-12-7-2)37(40)36-39(33-8-3,34-9-4)35-10-5/h8-10H,3-7,11-36H2,1-2H3/q+1