dimethyl 2,6-dimethyl-4-[2-methyl-5-nitroso-3-(phenylmethyl)imidazol-4-yl]pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-[2-methyl-5-nitroso-3-(phenylmethyl)imidazol-4-yl]pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-benzyl-2-methyl-5-nitroso-imidazol-4-yl)-2,6-dimethyl-pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-[2-methyl-5-nitroso-3-(phenylmethyl)-4-imidazolyl]pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-benzyl-2-methyl-5-nitrosoimidazol-4-yl)-2,6-dimethylpyridine-3,5-dicarboxylate Traditional Name: 4-(3-benzyl-2-methyl-5-nitroso-imidazol-4-yl)-2,6-dimethyl-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C22H22N4O5 MolecularWeight: 422.43388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)OC)C2=C(N=C(N2CC3=CC=CC=C3)C)N=O)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)OC)C2=C(N=C(N2CC3=CC=CC=C3)C)N=O)C(=O)OC

InChI

InChI=1S/C22H22N4O5/c1-12-16(21(27)30-4)18(17(13(2)23-12)22(28)31-5)19-20(25-29)24-14(3)26(19)11-15-9-7-6-8-10-15/h6-10H,11H2,1-5H3