propan-2-yl 3-(2-chlorophenyl)-3-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-chlorophenyl)-3-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]propanoate Openeye Name: isopropyl 3-(2-chlorophenyl)-3-[[1-(3-pyridylsulfonyl)piperidine-4-carbonyl]amino]propanoate CAS Name: 3-(2-chlorophenyl)-3-[[oxo-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-chlorophenyl)-3-[(1-pyridin-3-ylsulfonylpiperidine-4-carbonyl)amino]propanoate Traditional Name: 3-(2-chlorophenyl)-3-[[1-(3-pyridylsulfonyl)isonipecotoyl]amino]propionic acid isopropyl ester Formula: C23H28ClN3O5S MolecularWeight: 494.00352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C23H28ClN3O5S/c1-16(2)32-22(28)14-21(19-7-3-4-8-20(19)24)26-23(29)17-9-12-27(13-10-17)33(30,31)18-6-5-11-25-15-18/h3-8,11,15-17,21H,9-10,12-14H2,1-2H3,(H,26,29)