methyl 4-(4-propan-2-ylphenyl)sulfonyl-3-pyridin-2-ylsulfonyl-benzoate

Systemtic Name: methyl 4-(4-propan-2-ylphenyl)sulfonyl-3-pyridin-2-ylsulfonyl-benzoate Openeye Name: methyl 4-(4-isopropylphenyl)sulfonyl-3-(2-pyridylsulfonyl)benzoate CAS Name: 4-(4-propan-2-ylphenyl)sulfonyl-3-(2-pyridinylsulfonyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-propan-2-ylphenyl)sulfonyl-3-pyridin-2-ylsulfonylbenzoate Traditional Name: 4-p-cumenylsulfonyl-3-(2-pyridylsulfonyl)benzoic acid methyl ester Formula: C22H21NO6S2 MolecularWeight: 459.53524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=CC=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)C3=CC=CC=N3

InChI

InChI=1S/C22H21NO6S2/c1-15(2)16-7-10-18(11-8-16)30(25,26)19-12-9-17(22(24)29-3)14-20(19)31(27,28)21-6-4-5-13-23-21/h4-15H,1-3H3