[4-[2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)ethanoyl]phenyl] ethanoate

Systemtic Name: [4-[2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)ethanoyl]phenyl] ethanoate Openeye Name: [4-[2-(4,5-dimethylthiazol-3-ium-3-yl)acetyl]phenyl] acetate CAS Name: acetic acid [4-[2-(4,5-dimethyl-3-thiazol-3-iumyl)-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-(4,5-dimethyl-1,3-thiazol-3-ium-3-yl)acetyl]phenyl] acetate Traditional Name: acetic acid [4-[2-(4,5-dimethylthiazol-3-ium-3-yl)acetyl]phenyl] ester Formula: C15H16NO3S+ MolecularWeight: 290.35744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=[N+]1CC(=O)C2=CC=C(C=C2)OC(=O)C)C

Isomeric SMILES

CC1=C(SC=[N+]1CC(=O)C2=CC=C(C=C2)OC(=O)C)C

InChI

InChI=1S/C15H16NO3S/c1-10-11(2)20-9-16(10)8-15(18)13-4-6-14(7-5-13)19-12(3)17/h4-7,9H,8H2,1-3H3/q+1