4-(4-methoxycarbonylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(4-methoxycarbonylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[(4-methoxycarbonyl-1-piperidyl)sulfonyl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(4-methoxycarbonyl-1-piperidinyl)sulfonyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(4-methoxycarbonylpiperidin-1-yl)sulfonyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(4-carbomethoxypiperidino)sulfonyl-1H-pyrrole-2-carboxylic acid Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)O

Isomeric SMILES

COC(=O)C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)O

InChI

InChI=1S/C12H16N2O6S/c1-20-12(17)8-2-4-14(5-3-8)21(18,19)9-6-10(11(15)16)13-7-9/h6-8,13H,2-5H2,1H3,(H,15,16)