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

Systemtic Name: 3-[4-(3-methoxyphenyl)sulfonyl-5-phenyl-1,2,3-triazol-1-yl]benzoate Openeye Name: 3-[4-(3-methoxyphenyl)sulfonyl-5-phenyl-triazol-1-yl]benzoate CAS Name: 3-[4-(3-methoxyphenyl)sulfonyl-5-phenyl-1-triazolyl]benzoate IUPAC Name: 3-[4-(3-methoxyphenyl)sulfonyl-5-phenyltriazol-1-yl]benzoate Traditional Name: 3-[4-(3-methoxyphenyl)sulfonyl-5-phenyl-triazol-1-yl]benzoate Formula: C22H16N3O5S- MolecularWeight: 434.44454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)S(=O)(=O)C2=C(N(N=N2)C3=CC=CC(=C3)C(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC=C1)S(=O)(=O)C2=C(N(N=N2)C3=CC=CC(=C3)C(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O5S/c1-30-18-11-6-12-19(14-18)31(28,29)21-20(15-7-3-2-4-8-15)25(24-23-21)17-10-5-9-16(13-17)22(26)27/h2-14H,1H3,(H,26,27)/p-1