2-(5-chloranylbenzotriazol-1-yl)ethanoic acid

Systemtic Name: 2-(5-chloranylbenzotriazol-1-yl)ethanoic acid Openeye Name: 2-(5-chlorobenzotriazol-1-yl)acetic acid CAS Name: 2-(5-chloro-1-benzotriazolyl)acetic acid IUPAC Name: 2-(5-chlorobenzotriazol-1-yl)acetic acid Traditional Name: 2-(5-chlorobenzotriazol-1-yl)acetic acid Formula: C8H6ClN3O2 MolecularWeight: 211.60514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=NN2CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=NN2CC(=O)O

InChI

InChI=1S/C8H6ClN3O2/c9-5-1-2-7-6(3-5)10-11-12(7)4-8(13)14/h1-3H,4H2,(H,13,14)