2-[(4-fluorophenyl)sulfonylamino]propanoic acid; piperazine-1-carboxamide

Systemtic Name: 2-[(4-fluorophenyl)sulfonylamino]propanoic acid; piperazine-1-carboxamide Openeye Name: 2-[(4-fluorophenyl)sulfonylamino]propanoic acid; piperazine-1-carboxamide CAS Name: 2-[(4-fluorophenyl)sulfonylamino]propanoic acid; 1-piperazinecarboxamide IUPAC Name: 2-[(4-fluorophenyl)sulfonylamino]propanoic acid; piperazine-1-carboxamide Traditional Name: 2-[(4-fluorophenyl)sulfonylamino]propionic acid; piperazine-1-carboxamide Formula: C14H21FN4O5S MolecularWeight: 376.403743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)F.C1CN(CCN1)C(=O)N

Isomeric SMILES

CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)F.C1CN(CCN1)C(=O)N

InChI

InChI=1S/C9H10FNO4S.C5H11N3O/c1-6(9(12)13)11-16(14,15)8-4-2-7(10)3-5-8;6-5(9)8-3-1-7-2-4-8/h2-6,11H,1H3,(H,12,13);7H,1-4H2,(H2,6,9)