methyl 6-chloranyl-5-[(2-nitramido-4,5-dihydroimidazol-1-yl)methyl]pyridine-2-carboxylate

Systemtic Name: methyl 6-chloranyl-5-[(2-nitramido-4,5-dihydroimidazol-1-yl)methyl]pyridine-2-carboxylate Openeye Name: methyl 6-chloro-5-[(2-nitramido-4,5-dihydroimidazol-1-yl)methyl]pyridine-2-carboxylate CAS Name: 6-chloro-5-[(2-nitramido-4,5-dihydroimidazol-1-yl)methyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-chloro-5-[(2-nitramido-4,5-dihydroimidazol-1-yl)methyl]pyridine-2-carboxylate Traditional Name: 6-chloro-5-[(2-nitramido-2-imidazolin-1-yl)methyl]picolinic acid methyl ester Formula: C11H12ClN5O4 MolecularWeight: 313.69708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C(C=C1)CN2CCN=C2N[N+](=O)[O-])Cl

Isomeric SMILES

COC(=O)C1=NC(=C(C=C1)CN2CCN=C2N[N+](=O)[O-])Cl

InChI

InChI=1S/C11H12ClN5O4/c1-21-10(18)8-3-2-7(9(12)14-8)6-16-5-4-13-11(16)15-17(19)20/h2-3H,4-6H2,1H3,(H,13,15)