4-methyl-N-[(4S)-2-methyl-8-oxidanylidene-oct-6-yn-4-yl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(4S)-2-methyl-8-oxidanylidene-oct-6-yn-4-yl]benzenesulfonamide Openeye Name: N-[(1S)-1-isobutyl-5-oxo-pent-3-ynyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[(4S)-2-methyl-8-oxooct-6-yn-4-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(4S)-2-methyl-8-oxooct-6-yn-4-yl]benzenesulfonamide Traditional Name: N-[(1S)-1-isobutyl-5-keto-pent-3-ynyl]-4-methyl-benzenesulfonamide Formula: C16H21NO3S MolecularWeight: 307.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC#CC=O)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](CC#CC=O)CC(C)C

InChI

InChI=1S/C16H21NO3S/c1-13(2)12-15(6-4-5-11-18)17-21(19,20)16-9-7-14(3)8-10-16/h7-11,13,15,17H,6,12H2,1-3H3/t15-/m1/s1