3-[[2-[(2-methoxy-3-tetradecoxy-propoxy)methyl]phenyl]methyl]-1,3-thiazol-3-ium

Systemtic Name: 3-[[2-[(2-methoxy-3-tetradecoxy-propoxy)methyl]phenyl]methyl]-1,3-thiazol-3-ium Openeye Name: 3-[[2-[(2-methoxy-3-tetradecoxy-propoxy)methyl]phenyl]methyl]thiazol-3-ium CAS Name: 3-[[2-[(2-methoxy-3-tetradecoxypropoxy)methyl]phenyl]methyl]thiazol-3-ium IUPAC Name: 3-[[2-[(2-methoxy-3-tetradecoxypropoxy)methyl]phenyl]methyl]-1,3-thiazol-3-ium Traditional Name: 3-[2-[(2-methoxy-3-myristyloxy-propoxy)methyl]benzyl]thiazol-3-ium Formula: C29H48NO3S+ MolecularWeight: 490.76132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOCC(COCC1=CC=CC=C1C[N+]2=CSC=C2)OC

Isomeric SMILES

CCCCCCCCCCCCCCOCC(COCC1=CC=CC=C1C[N+]2=CSC=C2)OC

InChI

InChI=1S/C29H48NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-16-20-32-24-29(31-2)25-33-23-28-18-15-14-17-27(28)22-30-19-21-34-26-30/h14-15,17-19,21,26,29H,3-13,16,20,22-25H2,1-2H3/q+1