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

Systemtic Name: 3-[4-(2,4-dichlorophenyl)sulfonyl-5-phenyl-1,2,3-triazol-1-yl]benzoate Openeye Name: 3-[4-(2,4-dichlorophenyl)sulfonyl-5-phenyl-triazol-1-yl]benzoate CAS Name: 3-[4-(2,4-dichlorophenyl)sulfonyl-5-phenyl-1-triazolyl]benzoate IUPAC Name: 3-[4-(2,4-dichlorophenyl)sulfonyl-5-phenyltriazol-1-yl]benzoate Traditional Name: 3-[4-(2,4-dichlorophenyl)sulfonyl-5-phenyl-triazol-1-yl]benzoate Formula: C21H12Cl2N3O4S- MolecularWeight: 473.30868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13Cl2N3O4S/c22-15-9-10-18(17(23)12-15)31(29,30)20-19(13-5-2-1-3-6-13)26(25-24-20)16-8-4-7-14(11-16)21(27)28/h1-12H,(H,27,28)/p-1