4-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]butanoate

Systemtic Name: 4-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonylamino]butanoate Openeye Name: 4-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carbonyl)amino]butanoate CAS Name: 4-[[oxo-[4-(1-pyrrolidinylsulfonyl)-1H-pyrrol-2-yl]methyl]amino]butanoate IUPAC Name: 4-[(4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carbonyl)amino]butanoate Traditional Name: 4-[(4-pyrrolidinosulfonyl-1H-pyrrole-2-carbonyl)amino]butyrate Formula: C13H18N3O5S- MolecularWeight: 328.36412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)NCCCC(=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)NCCCC(=O)[O-]

InChI

InChI=1S/C13H19N3O5S/c17-12(18)4-3-5-14-13(19)11-8-10(9-15-11)22(20,21)16-6-1-2-7-16/h8-9,15H,1-7H2,(H,14,19)(H,17,18)/p-1