methyl 2,2-dimethyl-3-[(4-nitrophenyl)amino]propanoate

Systemtic Name: methyl 2,2-dimethyl-3-[(4-nitrophenyl)amino]propanoate Openeye Name: methyl 2,2-dimethyl-3-(4-nitroanilino)propanoate CAS Name: 2,2-dimethyl-3-(4-nitroanilino)propanoic acid methyl ester IUPAC Name: methyl 2,2-dimethyl-3-(4-nitroanilino)propanoate Traditional Name: 2,2-dimethyl-3-(4-nitroanilino)propionic acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)(CNC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C12H16N2O4/c1-12(2,11(15)18-3)8-13-9-4-6-10(7-5-9)14(16)17/h4-7,13H,8H2,1-3H3