ethyl 4-[[1-(phenylsulfonyl)piperidin-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[1-(phenylsulfonyl)piperidin-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[1-(benzenesulfonyl)piperidine-2-carbonyl]amino]benzoate CAS Name: 4-[[[1-(benzenesulfonyl)-2-piperidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(benzenesulfonyl)piperidine-2-carbonyl]amino]benzoate Traditional Name: 4-[(1-besylpipecoloyl)amino]benzoic acid ethyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5S/c1-2-28-21(25)16-11-13-17(14-12-16)22-20(24)19-10-6-7-15-23(19)29(26,27)18-8-4-3-5-9-18/h3-5,8-9,11-14,19H,2,6-7,10,15H2,1H3,(H,22,24)