(4-nitrophenyl) 2-(2-bromanylethanoylamino)-2-methyl-propanoate

Systemtic Name: (4-nitrophenyl) 2-(2-bromanylethanoylamino)-2-methyl-propanoate Openeye Name: (4-nitrophenyl) 2-[(2-bromoacetyl)amino]-2-methyl-propanoate CAS Name: 2-[(2-bromo-1-oxoethyl)amino]-2-methylpropanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-[(2-bromoacetyl)amino]-2-methylpropanoate Traditional Name: 2-[(2-bromoacetyl)amino]-2-methyl-propionic acid (4-nitrophenyl) ester Formula: C12H13BrN2O5 MolecularWeight: 345.14602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)CBr

Isomeric SMILES

CC(C)(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)CBr

InChI

InChI=1S/C12H13BrN2O5/c1-12(2,14-10(16)7-13)11(17)20-9-5-3-8(4-6-9)15(18)19/h3-6H,7H2,1-2H3,(H,14,16)