(3-cyanophenyl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate

Systemtic Name: (3-cyanophenyl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: (3-cyanophenyl)methyl 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid (3-cyanobenzyl) ester Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H13N3O5/c18-9-12-3-1-4-13(7-12)11-25-16(21)10-19-17(22)14-5-2-6-15(8-14)20(23)24/h1-8H,10-11H2,(H,19,22)