N-butyl-4-methyl-N-(4-phenylbut-1-ynyl)benzenesulfonamide

Systemtic Name: N-butyl-4-methyl-N-(4-phenylbut-1-ynyl)benzenesulfonamide Openeye Name: N-butyl-4-methyl-N-(4-phenylbut-1-ynyl)benzenesulfonamide CAS Name: N-butyl-4-methyl-N-(4-phenylbut-1-ynyl)benzenesulfonamide IUPAC Name: N-butyl-4-methyl-N-(4-phenylbut-1-ynyl)benzenesulfonamide Traditional Name: N-butyl-4-methyl-N-(4-phenylbut-1-ynyl)benzenesulfonamide Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C#CCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCN(C#CCCC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H25NO2S/c1-3-4-17-22(18-9-8-12-20-10-6-5-7-11-20)25(23,24)21-15-13-19(2)14-16-21/h5-7,10-11,13-16H,3-4,8,12,17H2,1-2H3