N-(2-methylbut-3-yn-2-yl)-3-[4-nitro-3-(trifluoromethyl)phenoxy]thiophene-2-carboxamide

Systemtic Name: N-(2-methylbut-3-yn-2-yl)-3-[4-nitro-3-(trifluoromethyl)phenoxy]thiophene-2-carboxamide Openeye Name: N-(1,1-dimethylprop-2-ynyl)-3-[4-nitro-3-(trifluoromethyl)phenoxy]thiophene-2-carboxamide CAS Name: N-(2-methylbut-3-yn-2-yl)-3-[4-nitro-3-(trifluoromethyl)phenoxy]-2-thiophenecarboxamide IUPAC Name: N-(2-methylbut-3-yn-2-yl)-3-[4-nitro-3-(trifluoromethyl)phenoxy]thiophene-2-carboxamide Traditional Name: N-(1,1-dimethylprop-2-ynyl)-3-[4-nitro-3-(trifluoromethyl)phenoxy]thiophene-2-carboxamide Formula: C17H13F3N2O4S MolecularWeight: 398.35633

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)NC(=O)C1=C(C=CS1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC(C)(C#C)NC(=O)C1=C(C=CS1)OC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C17H13F3N2O4S/c1-4-16(2,3)21-15(23)14-13(7-8-27-14)26-10-5-6-12(22(24)25)11(9-10)17(18,19)20/h1,5-9H,2-3H3,(H,21,23)