(2-methoxy-5-nitro-phenyl)methyl 3-[[2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 3-[[2,5-bis(oxidanylidene)imidazolidin-1-yl]methyl]benzoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate CAS Name: 3-[(2,5-dioxo-1-imidazolidinyl)methyl]benzoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate Traditional Name: 3-[(2,5-diketoimidazolidin-1-yl)methyl]benzoic acid (2-methoxy-5-nitro-benzyl) ester Formula: C19H17N3O7 MolecularWeight: 399.35418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)CN3C(=O)CNC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)C2=CC(=CC=C2)CN3C(=O)CNC3=O

InChI

InChI=1S/C19H17N3O7/c1-28-16-6-5-15(22(26)27)8-14(16)11-29-18(24)13-4-2-3-12(7-13)10-21-17(23)9-20-19(21)25/h2-8H,9-11H2,1H3,(H,20,25)