(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-bromanyl-3-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 4-bromanyl-3-nitro-benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C15H11BrN2O5 MolecularWeight: 379.16224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H11BrN2O5/c16-11-7-6-10(8-12(11)18(21)22)15(20)23-13(14(17)19)9-4-2-1-3-5-9/h1-8,13H,(H2,17,19)