3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]propanoic acid Openeye Name: 3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carbonyl)amino]propanoic acid CAS Name: 3-[[oxo-[4-(1-pyrrolidinylsulfonyl)-1H-pyrrol-2-yl]methyl]amino]propanoic acid IUPAC Name: 3-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carbonyl)amino]propanoic acid Traditional Name: 3-[(4-pyrrolidinosulfonyl-1H-pyrrole-2-carbonyl)amino]propionic acid Formula: C12H17N3O5S MolecularWeight: 315.34548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)NCCC(=O)O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)NCCC(=O)O

InChI

InChI=1S/C12H17N3O5S/c16-11(17)3-4-13-12(18)10-7-9(8-14-10)21(19,20)15-5-1-2-6-15/h7-8,14H,1-6H2,(H,13,18)(H,16,17)