butyl 4-[2-[2-(2-nitrophenoxy)ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[2-(2-nitrophenoxy)ethanoyloxy]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-(2-nitrophenoxy)acetyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[2-(2-nitrophenoxy)-1-oxoethoxy]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-(2-nitrophenoxy)acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[2-(2-nitrophenoxy)acetyl]oxyacetyl]amino]benzoic acid butyl ester Formula: C21H22N2O8 MolecularWeight: 430.40798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)COC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)COC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O8/c1-2-3-12-29-21(26)15-8-10-16(11-9-15)22-19(24)13-31-20(25)14-30-18-7-5-4-6-17(18)23(27)28/h4-11H,2-3,12-14H2,1H3,(H,22,24)