3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-(1-oxo-3-phenoxypropyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(3-phenoxypropanoyl)piperazino]propionic acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)C(=O)CCOC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CCC(=O)O)C(=O)CCOC2=CC=CC=C2

InChI

InChI=1S/C16H22N2O4/c19-15(7-13-22-14-4-2-1-3-5-14)18-11-9-17(10-12-18)8-6-16(20)21/h1-5H,6-13H2,(H,20,21)