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

Systemtic Name: 3-[4-[3-(4-nitrophenoxy)propanoyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[3-(4-nitrophenoxy)propanoyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[3-(4-nitrophenoxy)-1-oxopropyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[3-(4-nitrophenoxy)propanoyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[3-(4-nitrophenoxy)propanoyl]piperazino]propionic acid Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)O)C(=O)CCOC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC(=O)O)C(=O)CCOC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O6/c20-15(18-10-8-17(9-11-18)7-5-16(21)22)6-12-25-14-3-1-13(2-4-14)19(23)24/h1-4H,5-12H2,(H,21,22)