ethyl 2-[(3,4-dinitrophenyl)amino]propanoate

Systemtic Name: ethyl 2-[(3,4-dinitrophenyl)amino]propanoate Openeye Name: ethyl 2-(3,4-dinitroanilino)propanoate CAS Name: 2-(3,4-dinitroanilino)propanoic acid ethyl ester IUPAC Name: ethyl 2-(3,4-dinitroanilino)propanoate Traditional Name: 2-(3,4-dinitroanilino)propionic acid ethyl ester Formula: C11H13N3O6 MolecularWeight: 283.23742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)NC1=CC(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)NC1=CC(=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O6/c1-3-20-11(15)7(2)12-8-4-5-9(13(16)17)10(6-8)14(18)19/h4-7,12H,3H2,1-2H3