methyl 2-[4-(pyridin-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(pyridin-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(2-pyridylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-(2-pyridinylamino)methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(pyridin-2-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(2-pyridylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC=N3

InChI

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