(3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate

Systemtic Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-[(3-nitrophenyl)carbonylamino]ethanoate Openeye Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-[(3-nitrobenzoyl)amino]acetate CAS Name: 2-[[(3-nitrophenyl)-oxomethyl]amino]acetic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-methyl-1,2,4-oxadiazol-5-yl)methyl 2-[(3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-nitrobenzoyl)amino]acetic acid (3-methyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C13H12N4O6 MolecularWeight: 320.25758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=N1)COC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O6/c1-8-15-11(23-16-8)7-22-12(18)6-14-13(19)9-3-2-4-10(5-9)17(20)21/h2-5H,6-7H2,1H3,(H,14,19)