3-[(4-chlorophenyl)methyl]-1,3-benzothiazol-3-ium

Systemtic Name: 3-[(4-chlorophenyl)methyl]-1,3-benzothiazol-3-ium Openeye Name: 3-[(4-chlorophenyl)methyl]-1,3-benzothiazol-3-ium CAS Name: 3-[(4-chlorophenyl)methyl]-1,3-benzothiazol-3-ium IUPAC Name: 3-[(4-chlorophenyl)methyl]-1,3-benzothiazol-3-ium Traditional Name: 3-(4-chlorobenzyl)-1,3-benzothiazol-3-ium Formula: C14H11ClNS+ MolecularWeight: 260.76184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[N+](=CS2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)[N+](=CS2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H11ClNS/c15-12-7-5-11(6-8-12)9-16-10-17-14-4-2-1-3-13(14)16/h1-8,10H,9H2/q+1