ethyl 2-[(2-chloranyl-3,5-dinitro-phenyl)carbonylamino]ethanoate

Systemtic Name: ethyl 2-[(2-chloranyl-3,5-dinitro-phenyl)carbonylamino]ethanoate Openeye Name: ethyl 2-[(2-chloro-3,5-dinitro-benzoyl)amino]acetate CAS Name: 2-[[(2-chloro-3,5-dinitrophenyl)-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloro-3,5-dinitrobenzoyl)amino]acetate Traditional Name: 2-[(2-chloro-3,5-dinitro-benzoyl)amino]acetic acid ethyl ester Formula: C11H10ClN3O7 MolecularWeight: 331.666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1=CC(=CC(=C1Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CNC(=O)C1=CC(=CC(=C1Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H10ClN3O7/c1-2-22-9(16)5-13-11(17)7-3-6(14(18)19)4-8(10(7)12)15(20)21/h3-4H,2,5H2,1H3,(H,13,17)