methyl 1-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4-[methyl-(4-methylphenyl)sulfonyl-amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-[methyl(p-tolylsulfonyl)amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-[methyl-(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[methyl(tosyl)amino]benzoyl]isonipecotic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C22H26N2O5S/c1-16-4-10-20(11-5-16)30(27,28)23(2)19-8-6-17(7-9-19)21(25)24-14-12-18(13-15-24)22(26)29-3/h4-11,18H,12-15H2,1-3H3