(6-chloranylbenzotriazol-1-yl) phenylmethanesulfonate

Systemtic Name: (6-chloranylbenzotriazol-1-yl) phenylmethanesulfonate Openeye Name: (6-chlorobenzotriazol-1-yl) phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid (6-chloro-1-benzotriazolyl) ester IUPAC Name: (6-chlorobenzotriazol-1-yl) phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid (6-chlorobenzotriazol-1-yl) ester Formula: C13H10ClN3O3S MolecularWeight: 323.7548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)ON2C3=C(C=CC(=C3)Cl)N=N2

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)ON2C3=C(C=CC(=C3)Cl)N=N2

InChI

InChI=1S/C13H10ClN3O3S/c14-11-6-7-12-13(8-11)17(16-15-12)20-21(18,19)9-10-4-2-1-3-5-10/h1-8H,9H2