N-(2-acetamidoethyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-acetamidoethyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-acetamidoethyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-acetamidoethyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-acetamidoethyl)-1-[2-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(2-acetamidoethyl)-1-[2-(trifluoromethyl)phenyl]sulfonyl-isonipecotamide Formula: C17H22F3N3O4S MolecularWeight: 421.43449

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC(=O)NCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C17H22F3N3O4S/c1-12(24)21-8-9-22-16(25)13-6-10-23(11-7-13)28(26,27)15-5-3-2-4-14(15)17(18,19)20/h2-5,13H,6-11H2,1H3,(H,21,24)(H,22,25)