(4-nitrophenyl)methyl 2-acetamido-5-bromanyl-benzoate

Systemtic Name: (4-nitrophenyl)methyl 2-acetamido-5-bromanyl-benzoate Openeye Name: (4-nitrophenyl)methyl 2-acetamido-5-bromo-benzoate CAS Name: 2-acetamido-5-bromobenzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-acetamido-5-bromobenzoate Traditional Name: 2-acetamido-5-bromo-benzoic acid (4-nitrobenzyl) ester Formula: C16H13BrN2O5 MolecularWeight: 393.18882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)Br)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)Br)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13BrN2O5/c1-10(20)18-15-7-4-12(17)8-14(15)16(21)24-9-11-2-5-13(6-3-11)19(22)23/h2-8H,9H2,1H3,(H,18,20)