[(2-butoxy-3-nitro-phenyl)carbonylamino] ethanoate

Systemtic Name: [(2-butoxy-3-nitro-phenyl)carbonylamino] ethanoate Openeye Name: [(2-butoxy-3-nitro-benzoyl)amino] acetate CAS Name: acetic acid [[(2-butoxy-3-nitrophenyl)-oxomethyl]amino] ester IUPAC Name: [(2-butoxy-3-nitrobenzoyl)amino] acetate Traditional Name: acetic acid [(2-butoxy-3-nitro-benzoyl)amino] ester Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC=C1[N+](=O)[O-])C(=O)NOC(=O)C

Isomeric SMILES

CCCCOC1=C(C=CC=C1[N+](=O)[O-])C(=O)NOC(=O)C

InChI

InChI=1S/C13H16N2O6/c1-3-4-8-20-12-10(13(17)14-21-9(2)16)6-5-7-11(12)15(18)19/h5-7H,3-4,8H2,1-2H3,(H,14,17)