3-[4-(2-nitrophenyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(2-nitrophenyl)piperazin-1-yl]propanoic acid Openeye Name: 3-[4-(2-nitrophenyl)piperazin-1-yl]propanoic acid CAS Name: 3-[4-(2-nitrophenyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(2-nitrophenyl)piperazin-1-yl]propanoic acid Traditional Name: 3-[4-(2-nitrophenyl)piperazino]propionic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O4/c17-13(18)5-6-14-7-9-15(10-8-14)11-3-1-2-4-12(11)16(19)20/h1-4H,5-10H2,(H,17,18)