(2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-[methyl-(4-methylphenyl)sulfonyl-amino]benzoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 4-[methyl(p-tolylsulfonyl)amino]benzoate CAS Name: 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 4-[methyl-(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[methyl(tosyl)amino]benzoic acid (2-keto-2-piperidino-ethyl) 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)OCC(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)OCC(=O)N3CCCCC3

InChI

InChI=1S/C22H26N2O5S/c1-17-6-12-20(13-7-17)30(27,28)23(2)19-10-8-18(9-11-19)22(26)29-16-21(25)24-14-4-3-5-15-24/h6-13H,3-5,14-16H2,1-2H3