N-[1-(2,5-dimethylphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(2,5-dimethylphenyl)ethyl]-1-tosyl-isonipecotamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O3S/c1-16-6-9-21(10-7-16)29(27,28)25-13-11-20(12-14-25)23(26)24-19(4)22-15-17(2)5-8-18(22)3/h5-10,15,19-20H,11-14H2,1-4H3,(H,24,26)