methyl 2-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]benzoate Openeye Name: methyl 2-[[1-(3-pyridylsulfonyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-pyridin-3-ylsulfonylpiperidine-4-carbonyl)amino]benzoate Traditional Name: 2-[[1-(3-pyridylsulfonyl)isonipecotoyl]amino]benzoic acid methyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H21N3O5S/c1-27-19(24)16-6-2-3-7-17(16)21-18(23)14-8-11-22(12-9-14)28(25,26)15-5-4-10-20-13-15/h2-7,10,13-14H,8-9,11-12H2,1H3,(H,21,23)