[2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-bromophenyl)carbonylamino]ethanoate Openeye Name: [2-(2-fluoro-5-nitro-anilino)-2-oxo-ethyl] 2-[(4-bromobenzoyl)amino]acetate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]acetic acid [2-(2-fluoro-5-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-fluoro-5-nitroanilino)-2-oxoethyl] 2-[(4-bromobenzoyl)amino]acetate Traditional Name: 2-[(4-bromobenzoyl)amino]acetic acid [2-(2-fluoro-5-nitro-anilino)-2-keto-ethyl] ester Formula: C17H13BrFN3O6 MolecularWeight: 454.204023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCC(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCC(=O)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)Br

InChI

InChI=1S/C17H13BrFN3O6/c18-11-3-1-10(2-4-11)17(25)20-8-16(24)28-9-15(23)21-14-7-12(22(26)27)5-6-13(14)19/h1-7H,8-9H2,(H,20,25)(H,21,23)