methyl 3-(3-aminocarbonyl-2,6-dinitro-phenyl)propanoate

Systemtic Name: methyl 3-(3-aminocarbonyl-2,6-dinitro-phenyl)propanoate Openeye Name: methyl 3-(3-carbamoyl-2,6-dinitro-phenyl)propanoate CAS Name: 3-(3-carbamoyl-2,6-dinitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(3-carbamoyl-2,6-dinitrophenyl)propanoate Traditional Name: 3-(3-carbamoyl-2,6-dinitro-phenyl)propionic acid methyl ester Formula: C11H11N3O7 MolecularWeight: 297.22094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=C(C=CC(=C1[N+](=O)[O-])C(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCC1=C(C=CC(=C1[N+](=O)[O-])C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O7/c1-21-9(15)5-3-6-8(13(17)18)4-2-7(11(12)16)10(6)14(19)20/h2,4H,3,5H2,1H3,(H2,12,16)