N-[3-(phenylmethyl)-1,3-thiazol-3-ium-2-yl]ethanamide perchlorate

Systemtic Name: N-[3-(phenylmethyl)-1,3-thiazol-3-ium-2-yl]ethanamide perchlorate Openeye Name: N-(3-benzylthiazol-3-ium-2-yl)acetamide perchlorate CAS Name: N-[3-(phenylmethyl)-2-thiazol-3-iumyl]acetamide perchlorate IUPAC Name: N-(3-benzyl-1,3-thiazol-3-ium-2-yl)acetamide perchlorate Traditional Name: N-(3-benzylthiazol-3-ium-2-yl)acetamide perchlorate Formula: C12H13ClN2O5S MolecularWeight: 332.76002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=[N+](C=CS1)CC2=CC=CC=C2.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(=O)NC1=[N+](C=CS1)CC2=CC=CC=C2.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C12H12N2OS.ClHO4/c1-10(15)13-12-14(7-8-16-12)9-11-5-3-2-4-6-11;2-1(3,4)5/h2-8H,9H2,1H3;(H,2,3,4,5)