5-cyclopentyl-2-[4-(2-hydroxyethyl)phenyl]-4-iodanyl-3,6-dimethyl-benzenesulfonamide

Systemtic Name: 5-cyclopentyl-2-[4-(2-hydroxyethyl)phenyl]-4-iodanyl-3,6-dimethyl-benzenesulfonamide Openeye Name: 5-cyclopentyl-2-[4-(2-hydroxyethyl)phenyl]-4-iodo-3,6-dimethyl-benzenesulfonamide CAS Name: 5-cyclopentyl-2-[4-(2-hydroxyethyl)phenyl]-4-iodo-3,6-dimethylbenzenesulfonamide IUPAC Name: 5-cyclopentyl-2-[4-(2-hydroxyethyl)phenyl]-4-iodo-3,6-dimethylbenzenesulfonamide Traditional Name: 5-cyclopentyl-2-[4-(2-hydroxyethyl)phenyl]-4-iodo-3,6-dimethyl-benzenesulfonamide Formula: C21H26INO3S MolecularWeight: 499.40551

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C2CCCC2)I)C)C3=CC=C(C=C3)CCO)S(=O)(=O)N

Isomeric SMILES

CC1=C(C(=C(C(=C1C2CCCC2)I)C)C3=CC=C(C=C3)CCO)S(=O)(=O)N

InChI

InChI=1S/C21H26INO3S/c1-13-19(17-9-7-15(8-10-17)11-12-24)21(27(23,25)26)14(2)18(20(13)22)16-5-3-4-6-16/h7-10,16,24H,3-6,11-12H2,1-2H3,(H2,23,25,26)