N-(3-ethylpent-1-yn-3-yl)-2-methyl-5-methylsulfonyl-benzamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-2-methyl-5-methylsulfonyl-benzamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-2-methyl-5-methylsulfonyl-benzamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-2-methyl-5-methylsulfonylbenzamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-2-methyl-5-methylsulfonylbenzamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-5-mesyl-2-methyl-benzamide Formula: C16H21NO3S MolecularWeight: 307.40784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3S/c1-6-16(7-2,8-3)17-15(18)14-11-13(21(5,19)20)10-9-12(14)4/h1,9-11H,7-8H2,2-5H3,(H,17,18)