1-(3-phenacyl-1,3-thiazol-3-ium-2-yl)ethyl ethanoate bromide

Systemtic Name: 1-(3-phenacyl-1,3-thiazol-3-ium-2-yl)ethyl ethanoate bromide Openeye Name: 1-(3-phenacylthiazol-3-ium-2-yl)ethyl acetate bromide CAS Name: acetic acid 1-(3-phenacyl-2-thiazol-3-iumyl)ethyl ester bromide IUPAC Name: 1-(3-phenacyl-1,3-thiazol-3-ium-2-yl)ethyl acetate bromide Traditional Name: acetic acid 1-(3-phenacylthiazol-3-ium-2-yl)ethyl ester bromide Formula: C15H16BrNO3S MolecularWeight: 370.26144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=[N+](C=CS1)CC(=O)C2=CC=CC=C2)OC(=O)C.[Br-]

Isomeric SMILES

CC(C1=[N+](C=CS1)CC(=O)C2=CC=CC=C2)OC(=O)C.[Br-]

InChI

InChI=1S/C15H16NO3S.BrH/c1-11(19-12(2)17)15-16(8-9-20-15)10-14(18)13-6-4-3-5-7-13;/h3-9,11H,10H2,1-2H3;1H/q+1;/p-1