2-[[(4-nitrophenyl)methylamino]-propyl-amino]oxy-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[(4-nitrophenyl)methylamino]-propyl-amino]oxy-2-oxidanylidene-ethanoic acid Openeye Name: 2-[[(4-nitrophenyl)methylamino]-propyl-amino]oxy-2-oxo-acetic acid CAS Name: 2-[[(4-nitrophenyl)methylamino]-propylamino]oxy-2-oxoacetic acid IUPAC Name: 2-[[(4-nitrophenyl)methylamino]-propylamino]oxy-2-oxoacetic acid Traditional Name: 2-keto-2-[[(4-nitrobenzyl)amino]-propyl-amino]oxy-acetic acid Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(NCC1=CC=C(C=C1)[N+](=O)[O-])OC(=O)C(=O)O

Isomeric SMILES

CCCN(NCC1=CC=C(C=C1)[N+](=O)[O-])OC(=O)C(=O)O

InChI

InChI=1S/C12H15N3O6/c1-2-7-14(21-12(18)11(16)17)13-8-9-3-5-10(6-4-9)15(19)20/h3-6,13H,2,7-8H2,1H3,(H,16,17)