(4-bromophenyl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate

Systemtic Name: (4-bromophenyl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: (4-bromophenyl)methyl 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid (4-bromobenzyl) ester Formula: C16H13BrN2O5 MolecularWeight: 393.18882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrN2O5/c17-13-6-4-11(5-7-13)10-24-15(20)9-18-16(21)12-2-1-3-14(8-12)19(22)23/h1-8H,9-10H2,(H,18,21)