3-[4-(1H-pyrrol-2-ylcarbonyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(1H-pyrrol-2-ylcarbonyl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(1H-pyrrole-2-carbonyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-[oxo(1H-pyrrol-2-yl)methyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(1H-pyrrole-2-carbonyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(1H-pyrrole-2-carbonyl)piperazino]propionic acid Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)C(=O)C2=CC=CN2

Isomeric SMILES

C1CN(CCN1CCC(=O)O)C(=O)C2=CC=CN2

InChI

InChI=1S/C12H17N3O3/c16-11(17)3-5-14-6-8-15(9-7-14)12(18)10-2-1-4-13-10/h1-2,4,13H,3,5-9H2,(H,16,17)