4-[(E)-2-(3-heptyl-4-methyl-1,3-thiazol-3-ium-2-yl)ethenyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[(E)-2-(3-heptyl-4-methyl-1,3-thiazol-3-ium-2-yl)ethenyl]-N,N-dimethyl-aniline Openeye Name: 4-[(E)-2-(3-heptyl-4-methyl-thiazol-3-ium-2-yl)vinyl]-N,N-dimethyl-aniline CAS Name: 4-[(E)-2-(3-heptyl-4-methyl-2-thiazol-3-iumyl)ethenyl]-N,N-dimethylaniline IUPAC Name: 4-[(E)-2-(3-heptyl-4-methyl-1,3-thiazol-3-ium-2-yl)ethenyl]-N,N-dimethylaniline Traditional Name: [4-[(E)-2-(3-heptyl-4-methyl-thiazol-3-ium-2-yl)vinyl]phenyl]-dimethyl-amine Formula: C21H31N2S+ MolecularWeight: 343.54924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1=C(SC=C1C)C=CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCCCCC[N+]1=C(SC=C1C)/C=C/C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C21H31N2S/c1-5-6-7-8-9-16-23-18(2)17-24-21(23)15-12-19-10-13-20(14-11-19)22(3)4/h10-15,17H,5-9,16H2,1-4H3/q+1