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

Systemtic Name: 4-[5-(4-chlorophenyl)-4-(4-propan-2-ylphenyl)sulfonyl-1,2,3-triazol-1-yl]benzoate Openeye Name: 4-[5-(4-chlorophenyl)-4-(4-isopropylphenyl)sulfonyl-triazol-1-yl]benzoate CAS Name: 4-[5-(4-chlorophenyl)-4-(4-propan-2-ylphenyl)sulfonyl-1-triazolyl]benzoate IUPAC Name: 4-[5-(4-chlorophenyl)-4-(4-propan-2-ylphenyl)sulfonyltriazol-1-yl]benzoate Traditional Name: 4-[5-(4-chlorophenyl)-4-p-cumenylsulfonyl-triazol-1-yl]benzoate Formula: C24H19ClN3O4S- MolecularWeight: 480.94336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20ClN3O4S/c1-15(2)16-7-13-21(14-8-16)33(31,32)23-22(17-3-9-19(25)10-4-17)28(27-26-23)20-11-5-18(6-12-20)24(29)30/h3-15H,1-2H3,(H,29,30)/p-1