[3-[(5-bromanylfuran-2-yl)carbonylamino]phenyl] 4-nitrobenzoate

Systemtic Name: [3-[(5-bromanylfuran-2-yl)carbonylamino]phenyl] 4-nitrobenzoate Openeye Name: [3-[(5-bromofuran-2-carbonyl)amino]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-[[(5-bromo-2-furanyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [3-[(5-bromofuran-2-carbonyl)amino]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-[(5-bromo-2-furoyl)amino]phenyl] ester Formula: C18H11BrN2O6 MolecularWeight: 431.19374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C18H11BrN2O6/c19-16-9-8-15(27-16)17(22)20-12-2-1-3-14(10-12)26-18(23)11-4-6-13(7-5-11)21(24)25/h1-10H,(H,20,22)