3-[(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]propanoic acid

Systemtic Name: 3-[(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylamino]propanoic acid Openeye Name: 3-[(4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoyl)amino]propanoic acid CAS Name: 3-[[[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(4-chloro-3-pyrrolidin-1-ylsulfonylbenzoyl)amino]propanoic acid Traditional Name: 3-[(4-chloro-3-pyrrolidinosulfonyl-benzoyl)amino]propionic acid Formula: C14H17ClN2O5S MolecularWeight: 360.81318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC(=O)O)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC(=O)O)Cl

InChI

InChI=1S/C14H17ClN2O5S/c15-11-4-3-10(14(20)16-6-5-13(18)19)9-12(11)23(21,22)17-7-1-2-8-17/h3-4,9H,1-2,5-8H2,(H,16,20)(H,18,19)