2-[(4-nitrophenyl)methoxycarbonylamino]butanoic acid

Systemtic Name: 2-[(4-nitrophenyl)methoxycarbonylamino]butanoic acid Openeye Name: 2-[(4-nitrophenyl)methoxycarbonylamino]butanoic acid CAS Name: 2-[[(4-nitrophenyl)methoxy-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(4-nitrophenyl)methoxycarbonylamino]butanoic acid Traditional Name: 2-[(4-nitrobenzyl)oxycarbonylamino]butyric acid Formula: C12H14N2O6 MolecularWeight: 282.24936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)O)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O6/c1-2-10(11(15)16)13-12(17)20-7-8-3-5-9(6-4-8)14(18)19/h3-6,10H,2,7H2,1H3,(H,13,17)(H,15,16)