(5-chloranyl-2,1-benzothiazol-3-yl) benzoate

Systemtic Name: (5-chloranyl-2,1-benzothiazol-3-yl) benzoate Openeye Name: (5-chloro-2,1-benzothiazol-3-yl) benzoate CAS Name: benzoic acid (5-chloro-2,1-benzothiazol-3-yl) ester IUPAC Name: (5-chloro-2,1-benzothiazol-3-yl) benzoate Traditional Name: benzoic acid (5-chloro-2,1-benzothiazol-3-yl) ester Formula: C14H8ClNO2S MolecularWeight: 289.73682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=C3C=C(C=CC3=NS2)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=C3C=C(C=CC3=NS2)Cl

InChI

InChI=1S/C14H8ClNO2S/c15-10-6-7-12-11(8-10)14(19-16-12)18-13(17)9-4-2-1-3-5-9/h1-8H