methyl 2-[(3-methyl-5-nitro-imidazol-4-yl)amino]benzoate

Systemtic Name: methyl 2-[(3-methyl-5-nitro-imidazol-4-yl)amino]benzoate Openeye Name: methyl 2-[(3-methyl-5-nitro-imidazol-4-yl)amino]benzoate CAS Name: 2-[(3-methyl-5-nitro-4-imidazolyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3-methyl-5-nitroimidazol-4-yl)amino]benzoate Traditional Name: 2-[(3-methyl-5-nitro-imidazol-4-yl)amino]benzoic acid methyl ester Formula: C12H12N4O4 MolecularWeight: 276.24808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4/c1-15-7-13-10(16(18)19)11(15)14-9-6-4-3-5-8(9)12(17)20-2/h3-7,14H,1-2H3