N-[2-(3-chlorophenyl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3-chlorophenyl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(3-chlorophenyl)ethyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3-chlorophenyl)ethyl]-1-mesitylsulfonyl-isonipecotamide Formula: C23H29ClN2O3S MolecularWeight: 449.00596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C23H29ClN2O3S/c1-16-13-17(2)22(18(3)14-16)30(28,29)26-11-8-20(9-12-26)23(27)25-10-7-19-5-4-6-21(24)15-19/h4-6,13-15,20H,7-12H2,1-3H3,(H,25,27)