3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)quinoline

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)quinoline Openeye Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)quinoline CAS Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)quinoline IUPAC Name: 3-(4-chlorophenyl)sulfonyl-2-(5-methylsulfonylpentyl)quinoline Traditional Name: 3-(4-chlorophenyl)sulfonyl-2-(5-mesylpentyl)quinoline Formula: C21H22ClNO4S2 MolecularWeight: 451.98668

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCCCCC1=NC2=CC=CC=C2C=C1S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)CCCCCC1=NC2=CC=CC=C2C=C1S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO4S2/c1-28(24,25)14-6-2-3-9-20-21(15-16-7-4-5-8-19(16)23-20)29(26,27)18-12-10-17(22)11-13-18/h4-5,7-8,10-13,15H,2-3,6,9,14H2,1H3