(E)-5-[2-(2-bromanyl-5-nitro-phenyl)ethanoyl-[(2-methylpropan-2-yl)oxy]amino]pent-2-enoate

Systemtic Name: (E)-5-[2-(2-bromanyl-5-nitro-phenyl)ethanoyl-[(2-methylpropan-2-yl)oxy]amino]pent-2-enoate Openeye Name: (E)-5-[[2-(2-bromo-5-nitro-phenyl)acetyl]-tert-butoxy-amino]pent-2-enoate CAS Name: (E)-5-[[2-(2-bromo-5-nitrophenyl)-1-oxoethyl]-[(2-methylpropan-2-yl)oxy]amino]-2-pentenoate IUPAC Name: (E)-5-[[2-(2-bromo-5-nitrophenyl)acetyl]-[(2-methylpropan-2-yl)oxy]amino]pent-2-enoate Traditional Name: (E)-5-[[2-(2-bromo-5-nitro-phenyl)acetyl]-tert-butoxy-amino]pent-2-enoate Formula: C17H20BrN2O6- MolecularWeight: 428.2545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ON(CCC=CC(=O)[O-])C(=O)CC1=C(C=CC(=C1)[N+](=O)[O-])Br

Isomeric SMILES

CC(C)(C)ON(CC/C=C/C(=O)[O-])C(=O)CC1=C(C=CC(=C1)[N+](=O)[O-])Br

InChI

InChI=1S/C17H21BrN2O6/c1-17(2,3)26-19(9-5-4-6-16(22)23)15(21)11-12-10-13(20(24)25)7-8-14(12)18/h4,6-8,10H,5,9,11H2,1-3H3,(H,22,23)/p-1/b6-4+