N-[2,2,2-tris(chloranyl)-1-(4-methylphenyl)sulfonyl-ethyl]pentanamide

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-(4-methylphenyl)sulfonyl-ethyl]pentanamide Openeye Name: N-[2,2,2-trichloro-1-(p-tolylsulfonyl)ethyl]pentanamide CAS Name: N-[2,2,2-trichloro-1-(4-methylphenyl)sulfonylethyl]pentanamide IUPAC Name: N-[2,2,2-trichloro-1-(4-methylphenyl)sulfonylethyl]pentanamide Traditional Name: N-(2,2,2-trichloro-1-tosyl-ethyl)valeramide Formula: C14H18Cl3NO3S MolecularWeight: 386.72162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(C(Cl)(Cl)Cl)S(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCC(=O)NC(C(Cl)(Cl)Cl)S(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C14H18Cl3NO3S/c1-3-4-5-12(19)18-13(14(15,16)17)22(20,21)11-8-6-10(2)7-9-11/h6-9,13H,3-5H2,1-2H3,(H,18,19)