2-oxidanylidenepropyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: 2-oxidanylidenepropyl 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: acetonyl 2-[(4-chloro-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]acetic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 2-[(4-chloro-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]acetic acid acetonyl ester Formula: C12H11ClN2O6 MolecularWeight: 314.67854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)CNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)COC(=O)CNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H11ClN2O6/c1-7(16)6-21-11(17)5-14-12(18)8-2-3-9(13)10(4-8)15(19)20/h2-4H,5-6H2,1H3,(H,14,18)