4-chloranyl-N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-N-(4-methyl-1-oxidanyl-pentan-2-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-N-(4-methyl-1-oxidanyl-pentan-2-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[1-(hydroxymethyl)-3-methyl-butyl]-N-[(E)-3-(2-methoxyphenyl)allyl]benzenesulfonamide CAS Name: 4-chloro-N-(1-hydroxy-4-methylpentan-2-yl)-N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]benzenesulfonamide IUPAC Name: 4-chloro-N-(1-hydroxy-4-methylpentan-2-yl)-N-[(E)-3-(2-methoxyphenyl)prop-2-enyl]benzenesulfonamide Traditional Name: 4-chloro-N-[(E)-3-(2-methoxyphenyl)allyl]-N-(3-methyl-1-methylol-butyl)benzenesulfonamide Formula: C22H28ClNO4S MolecularWeight: 437.98002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)N(CC=CC1=CC=CC=C1OC)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CC(CO)N(C/C=C/C1=CC=CC=C1OC)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H28ClNO4S/c1-17(2)15-20(16-25)24(29(26,27)21-12-10-19(23)11-13-21)14-6-8-18-7-4-5-9-22(18)28-3/h4-13,17,20,25H,14-16H2,1-3H3/b8-6+