(4-nitrophenyl)methyl 2-[(3-chloranyl-5-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-[(3-chloranyl-5-nitro-phenyl)carbonylamino]ethanoate Openeye Name: (4-nitrophenyl)methyl 2-[(3-chloro-5-nitro-benzoyl)amino]acetate CAS Name: 2-[[(3-chloro-5-nitrophenyl)-oxomethyl]amino]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[(3-chloro-5-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-chloro-5-nitro-benzoyl)amino]acetic acid (4-nitrobenzyl) ester Formula: C16H12ClN3O7 MolecularWeight: 393.73538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CNC(=O)C2=CC(=CC(=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CNC(=O)C2=CC(=CC(=C2)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O7/c17-12-5-11(6-14(7-12)20(25)26)16(22)18-8-15(21)27-9-10-1-3-13(4-2-10)19(23)24/h1-7H,8-9H2,(H,18,22)