(2S)-2-[(4-morpholin-4-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]propanoate

Systemtic Name: (2S)-2-[(4-morpholin-4-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]propanoate Openeye Name: (2S)-2-[(4-morpholinosulfonyl-1H-pyrrole-2-carbonyl)amino]propanoate CAS Name: (2S)-2-[[[4-(4-morpholinylsulfonyl)-1H-pyrrol-2-yl]-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-[(4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carbonyl)amino]propanoate Traditional Name: (2S)-2-[(4-morpholinosulfonyl-1H-pyrrole-2-carbonyl)amino]propionate Formula: C12H16N3O6S- MolecularWeight: 330.33694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)C1=CC(=CN1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)C1=CC(=CN1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C12H17N3O6S/c1-8(12(17)18)14-11(16)10-6-9(7-13-10)22(19,20)15-2-4-21-5-3-15/h6-8,13H,2-5H2,1H3,(H,14,16)(H,17,18)/p-1/t8-/m0/s1