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

Systemtic Name: 2-[[4-(4-nitrophenyl)piperazin-1-yl]carbonylamino]propanoic acid Openeye Name: 2-[[4-(4-nitrophenyl)piperazine-1-carbonyl]amino]propanoic acid CAS Name: 2-[[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[4-(4-nitrophenyl)piperazine-1-carbonyl]amino]propanoic acid Traditional Name: 2-[[4-(4-nitrophenyl)piperazine-1-carbonyl]amino]propionic acid Formula: C14H18N4O5 MolecularWeight: 322.31652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)O)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O5/c1-10(13(19)20)15-14(21)17-8-6-16(7-9-17)11-2-4-12(5-3-11)18(22)23/h2-5,10H,6-9H2,1H3,(H,15,21)(H,19,20)