2-[2-[(E)-heptadec-8-enyl]-1-phenethyl-4,5-dihydroimidazol-1-ium-1-yl]ethanol

Systemtic Name: 2-[2-[(E)-heptadec-8-enyl]-1-phenethyl-4,5-dihydroimidazol-1-ium-1-yl]ethanol Openeye Name: 2-[2-[(E)-heptadec-8-enyl]-1-phenethyl-4,5-dihydroimidazol-1-ium-1-yl]ethanol CAS Name: 2-[2-[(E)-heptadec-8-enyl]-1-phenethyl-4,5-dihydroimidazol-1-ium-1-yl]ethanol IUPAC Name: 2-[2-[(E)-heptadec-8-enyl]-1-phenethyl-4,5-dihydroimidazol-1-ium-1-yl]ethanol Traditional Name: 2-[2-[(E)-heptadec-8-enyl]-1-phenethyl-2-imidazolin-1-ium-1-yl]ethanol Formula: C30H51N2O+ MolecularWeight: 455.73874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC1=NCC[N+]1(CCC2=CC=CC=C2)CCO

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC1=NCC[N+]1(CCC2=CC=CC=C2)CCO

InChI

InChI=1S/C30H51N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-30-31-24-26-32(30,27-28-33)25-23-29-20-17-16-18-21-29/h9-10,16-18,20-21,33H,2-8,11-15,19,22-28H2,1H3/q+1/b10-9+