4-[2-(4-nitrophenoxy)ethanoylamino]butanoic acid

Systemtic Name: 4-[2-(4-nitrophenoxy)ethanoylamino]butanoic acid Openeye Name: 4-[[2-(4-nitrophenoxy)acetyl]amino]butanoic acid CAS Name: 4-[[2-(4-nitrophenoxy)-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(4-nitrophenoxy)acetyl]amino]butanoic acid Traditional Name: 4-[[2-(4-nitrophenoxy)acetyl]amino]butyric acid Formula: C12H14N2O6 MolecularWeight: 282.24936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NCCCC(=O)O

InChI

InChI=1S/C12H14N2O6/c15-11(13-7-1-2-12(16)17)8-20-10-5-3-9(4-6-10)14(18)19/h3-6H,1-2,7-8H2,(H,13,15)(H,16,17)