4-[4-(2-chlorophenyl)sulfonyl-5-phenyl-1,2,3-triazol-1-yl]benzoate

Systemtic Name: 4-[4-(2-chlorophenyl)sulfonyl-5-phenyl-1,2,3-triazol-1-yl]benzoate Openeye Name: 4-[4-(2-chlorophenyl)sulfonyl-5-phenyl-triazol-1-yl]benzoate CAS Name: 4-[4-(2-chlorophenyl)sulfonyl-5-phenyl-1-triazolyl]benzoate IUPAC Name: 4-[4-(2-chlorophenyl)sulfonyl-5-phenyltriazol-1-yl]benzoate Traditional Name: 4-[4-(2-chlorophenyl)sulfonyl-5-phenyl-triazol-1-yl]benzoate Formula: C21H13ClN3O4S- MolecularWeight: 438.86362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NN2C3=CC=C(C=C3)C(=O)[O-])S(=O)(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NN2C3=CC=C(C=C3)C(=O)[O-])S(=O)(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H14ClN3O4S/c22-17-8-4-5-9-18(17)30(28,29)20-19(14-6-2-1-3-7-14)25(24-23-20)16-12-10-15(11-13-16)21(26)27/h1-13H,(H,26,27)/p-1