4-[1-(2-nitrophenyl)ethoxycarbonylamino]butanoic acid

Systemtic Name: 4-[1-(2-nitrophenyl)ethoxycarbonylamino]butanoic acid Openeye Name: 4-[1-(2-nitrophenyl)ethoxycarbonylamino]butanoic acid CAS Name: 4-[[1-(2-nitrophenyl)ethoxy-oxomethyl]amino]butanoic acid IUPAC Name: 4-[1-(2-nitrophenyl)ethoxycarbonylamino]butanoic acid Traditional Name: 4-[1-(2-nitrophenyl)ethoxycarbonylamino]butyric acid Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O6/c1-9(10-5-2-3-6-11(10)15(19)20)21-13(18)14-8-4-7-12(16)17/h2-3,5-6,9H,4,7-8H2,1H3,(H,14,18)(H,16,17)