2-(4-bromanylphenoxy)ethyl 2-[(3-chloranyl-5-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: 2-(4-bromanylphenoxy)ethyl 2-[(3-chloranyl-5-nitro-phenyl)carbonylamino]ethanoate Openeye Name: 2-(4-bromophenoxy)ethyl 2-[(3-chloro-5-nitro-benzoyl)amino]acetate CAS Name: 2-[[(3-chloro-5-nitrophenyl)-oxomethyl]amino]acetic acid 2-(4-bromophenoxy)ethyl ester IUPAC Name: 2-(4-bromophenoxy)ethyl 2-[(3-chloro-5-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-chloro-5-nitro-benzoyl)amino]acetic acid 2-(4-bromophenoxy)ethyl ester Formula: C17H14BrClN2O6 MolecularWeight: 457.65986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCOC(=O)CNC(=O)C2=CC(=CC(=C2)Cl)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1OCCOC(=O)CNC(=O)C2=CC(=CC(=C2)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C17H14BrClN2O6/c18-12-1-3-15(4-2-12)26-5-6-27-16(22)10-20-17(23)11-7-13(19)9-14(8-11)21(24)25/h1-4,7-9H,5-6,10H2,(H,20,23)