1,3-benzothiazol-2-ylmethyl 4-chloranylbenzenesulfonate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-chloranylbenzenesulfonate Openeye Name: 1,3-benzothiazol-2-ylmethyl 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C14H10ClNO3S2 MolecularWeight: 339.8171

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H10ClNO3S2/c15-10-5-7-11(8-6-10)21(17,18)19-9-14-16-12-3-1-2-4-13(12)20-14/h1-8H,9H2