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

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-(4-methylphenyl)sulfonyl-ethyl]octadecanamide Openeye Name: N-[2,2,2-trichloro-1-(p-tolylsulfonyl)ethyl]octadecanamide CAS Name: N-[2,2,2-trichloro-1-(4-methylphenyl)sulfonylethyl]octadecanamide IUPAC Name: N-[2,2,2-trichloro-1-(4-methylphenyl)sulfonylethyl]octadecanamide Traditional Name: N-(2,2,2-trichloro-1-tosyl-ethyl)stearamide Formula: C27H44Cl3NO3S MolecularWeight: 569.06716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H44Cl3NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25(32)31-26(27(28,29)30)35(33,34)24-21-19-23(2)20-22-24/h19-22,26H,3-18H2,1-2H3,(H,31,32)