propyl 4-[[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[1-(p-tolylsulfonyl)piperidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[1-(4-methylphenyl)sulfonyl-2-piperidinyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[1-(4-methylphenyl)sulfonylpiperidine-2-carbonyl]amino]benzoate Traditional Name: 4-[(1-tosylpipecoloyl)amino]benzoic acid propyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H28N2O5S/c1-3-16-30-23(27)18-9-11-19(12-10-18)24-22(26)21-6-4-5-15-25(21)31(28,29)20-13-7-17(2)8-14-20/h7-14,21H,3-6,15-16H2,1-2H3,(H,24,26)