tert-butyl 2-[bis(1-methylimidazol-2-yl)methyl]-3-methyl-imidazole-4-carboxylate

Systemtic Name: tert-butyl 2-[bis(1-methylimidazol-2-yl)methyl]-3-methyl-imidazole-4-carboxylate Openeye Name: tert-butyl 2-[bis(1-methylimidazol-2-yl)methyl]-3-methyl-imidazole-4-carboxylate CAS Name: 2-[bis(1-methyl-2-imidazolyl)methyl]-3-methyl-4-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[bis(1-methylimidazol-2-yl)methyl]-3-methylimidazole-4-carboxylate Traditional Name: 2-[bis(1-methylimidazol-2-yl)methyl]-3-methyl-imidazole-4-carboxylic acid tert-butyl ester Formula: C18H24N6O2 MolecularWeight: 356.42216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CN=C(N1C)C(C2=NC=CN2C)C3=NC=CN3C

Isomeric SMILES

CC(C)(C)OC(=O)C1=CN=C(N1C)C(C2=NC=CN2C)C3=NC=CN3C

InChI

InChI=1S/C18H24N6O2/c1-18(2,3)26-17(25)12-11-21-16(24(12)6)13(14-19-7-9-22(14)4)15-20-8-10-23(15)5/h7-11,13H,1-6H3