2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-5-yl)ethanoic acid

Systemtic Name: 2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-5-yl)ethanoic acid Openeye Name: 2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-5-yl)acetic acid CAS Name: 2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-5-yl)acetic acid IUPAC Name: 2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-5-yl)acetic acid Traditional Name: 2-(4-chlorophenyl)-2-(1H-1,2,4-triazol-5-yl)acetic acid Formula: C10H8ClN3O2 MolecularWeight: 237.64242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=NC=NN2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(C2=NC=NN2)C(=O)O)Cl

InChI

InChI=1S/C10H8ClN3O2/c11-7-3-1-6(2-4-7)8(10(15)16)9-12-5-13-14-9/h1-5,8H,(H,15,16)(H,12,13,14)