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

Systemtic Name: 4-methyl-N-[(4S)-2-methyl-8-oxidanylidene-dec-6-yn-4-yl]benzenesulfonamide Openeye Name: N-[(1S)-1-isobutyl-5-oxo-hept-3-ynyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[(4S)-2-methyl-8-oxodec-6-yn-4-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(4S)-2-methyl-8-oxodec-6-yn-4-yl]benzenesulfonamide Traditional Name: N-[(1S)-1-isobutyl-5-keto-hept-3-ynyl]-4-methyl-benzenesulfonamide Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C#CCC(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCC(=O)C#CC[C@H](CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C18H25NO3S/c1-5-17(20)8-6-7-16(13-14(2)3)19-23(21,22)18-11-9-15(4)10-12-18/h9-12,14,16,19H,5,7,13H2,1-4H3/t16-/m1/s1