N-but-3-ynyl-1-(2,6-dimethylphenyl)methanesulfonamide

Systemtic Name: N-but-3-ynyl-1-(2,6-dimethylphenyl)methanesulfonamide Openeye Name: N-but-3-ynyl-1-(2,6-dimethylphenyl)methanesulfonamide CAS Name: N-but-3-ynyl-1-(2,6-dimethylphenyl)methanesulfonamide IUPAC Name: N-but-3-ynyl-1-(2,6-dimethylphenyl)methanesulfonamide Traditional Name: N-but-3-ynyl-1-(2,6-dimethylphenyl)methanesulfonamide Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)CS(=O)(=O)NCCC#C

Isomeric SMILES

CC1=C(C(=CC=C1)C)CS(=O)(=O)NCCC#C

InChI

InChI=1S/C13H17NO2S/c1-4-5-9-14-17(15,16)10-13-11(2)7-6-8-12(13)3/h1,6-8,14H,5,9-10H2,2-3H3