4-[(3S)-3-aminocarbonylpiperidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: 4-[(3S)-3-aminocarbonylpiperidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate Openeye Name: 4-[[(3S)-3-carbamoyl-1-piperidyl]sulfonyl]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[(3S)-3-carbamoyl-1-piperidinyl]sulfonyl]-1-methyl-2-pyrrolecarboxylate IUPAC Name: 4-[(3S)-3-carbamoylpiperidin-1-yl]sulfonyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-[(3S)-3-carbamoylpiperidino]sulfonyl-1-methyl-pyrrole-2-carboxylate Formula: C12H16N3O5S- MolecularWeight: 314.33754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)N2CCCC(C2)C(=O)N

Isomeric SMILES

CN1C=C(C=C1C(=O)[O-])S(=O)(=O)N2CCC[C@@H](C2)C(=O)N

InChI

InChI=1S/C12H17N3O5S/c1-14-7-9(5-10(14)12(17)18)21(19,20)15-4-2-3-8(6-15)11(13)16/h5,7-8H,2-4,6H2,1H3,(H2,13,16)(H,17,18)/p-1/t8-/m0/s1