N-(4-chloranylbut-2-ynyl)-4-methyl-N-[[(2S,3R)-3-propyloxiran-2-yl]methyl]benzenesulfonamide

Systemtic Name: N-(4-chloranylbut-2-ynyl)-4-methyl-N-[[(2S,3R)-3-propyloxiran-2-yl]methyl]benzenesulfonamide Openeye Name: N-(4-chlorobut-2-ynyl)-4-methyl-N-[[(2S,3R)-3-propyloxiran-2-yl]methyl]benzenesulfonamide CAS Name: N-(4-chlorobut-2-ynyl)-4-methyl-N-[[(2S,3R)-3-propyl-2-oxiranyl]methyl]benzenesulfonamide IUPAC Name: N-(4-chlorobut-2-ynyl)-4-methyl-N-[[(2S,3R)-3-propyloxiran-2-yl]methyl]benzenesulfonamide Traditional Name: N-(4-chlorobut-2-ynyl)-4-methyl-N-[[(2S,3R)-3-propyloxiran-2-yl]methyl]benzenesulfonamide Formula: C17H22ClNO3S MolecularWeight: 355.87948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(O1)CN(CC#CCCl)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC[C@@H]1[C@@H](O1)CN(CC#CCCl)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H22ClNO3S/c1-3-6-16-17(22-16)13-19(12-5-4-11-18)23(20,21)15-9-7-14(2)8-10-15/h7-10,16-17H,3,6,11-13H2,1-2H3/t16-,17+/m1/s1