4-chloranyl-N-(4-methyl-1-oxidanyl-pentan-2-yl)-N-(3-phenylpropyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(4-methyl-1-oxidanyl-pentan-2-yl)-N-(3-phenylpropyl)benzenesulfonamide Openeye Name: 4-chloro-N-[1-(hydroxymethyl)-3-methyl-butyl]-N-(3-phenylpropyl)benzenesulfonamide CAS Name: 4-chloro-N-(1-hydroxy-4-methylpentan-2-yl)-N-(3-phenylpropyl)benzenesulfonamide IUPAC Name: 4-chloro-N-(1-hydroxy-4-methylpentan-2-yl)-N-(3-phenylpropyl)benzenesulfonamide Traditional Name: 4-chloro-N-(3-methyl-1-methylol-butyl)-N-(3-phenylpropyl)benzenesulfonamide Formula: C21H28ClNO3S MolecularWeight: 409.96992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)N(CCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(CO)N(CCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H28ClNO3S/c1-17(2)15-20(16-24)23(14-6-9-18-7-4-3-5-8-18)27(25,26)21-12-10-19(22)11-13-21/h3-5,7-8,10-13,17,20,24H,6,9,14-16H2,1-2H3