(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C22H15ClN2O6 MolecularWeight: 438.8173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H15ClN2O6/c23-17-11-10-14(12-18(17)25(29)30)19(26)15-8-4-5-9-16(15)22(28)31-20(21(24)27)13-6-2-1-3-7-13/h1-12,20H,(H2,24,27)