5-[(4-chloranylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-sulfonic acid

Systemtic Name: 5-[(4-chloranylphenoxy)methyl]-4-phenyl-1,2,4-triazole-3-sulfonic acid Openeye Name: 5-[(4-chlorophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-sulfonic acid CAS Name: 5-[(4-chlorophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-sulfonic acid IUPAC Name: 5-[(4-chlorophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-sulfonic acid Traditional Name: 5-[(4-chlorophenoxy)methyl]-4-phenyl-1,2,4-triazole-3-sulfonic acid Formula: C15H12ClN3O4S MolecularWeight: 365.79148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2S(=O)(=O)O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2S(=O)(=O)O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClN3O4S/c16-11-6-8-13(9-7-11)23-10-14-17-18-15(24(20,21)22)19(14)12-4-2-1-3-5-12/h1-9H,10H2,(H,20,21,22)