N-(3-ethylpent-1-yn-3-yl)-4-methylsulfonyl-benzamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-4-methylsulfonyl-benzamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-4-methylsulfonyl-benzamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-4-methylsulfonylbenzamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-4-methylsulfonylbenzamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-4-mesyl-benzamide Formula: C15H19NO3S MolecularWeight: 293.38126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3S/c1-5-15(6-2,7-3)16-14(17)12-8-10-13(11-9-12)20(4,18)19/h1,8-11H,6-7H2,2-4H3,(H,16,17)