tert-butyl 4-(6-chloranyl-1H-benzimidazol-5-yl)-3-methyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-chloranyl-1H-benzimidazol-5-yl)-3-methyl-piperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-chloro-1H-benzimidazol-5-yl)-3-methyl-piperazine-1-carboxylate CAS Name: 4-(6-chloro-1H-benzimidazol-5-yl)-3-methyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-chloro-1H-benzimidazol-5-yl)-3-methylpiperazine-1-carboxylate Traditional Name: 4-(6-chloro-1H-benzimidazol-5-yl)-3-methyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C17H23ClN4O2 MolecularWeight: 350.84312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=C(C=C3C(=C2)N=CN3)Cl)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CN(CCN1C2=C(C=C3C(=C2)N=CN3)Cl)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H23ClN4O2/c1-11-9-21(16(23)24-17(2,3)4)5-6-22(11)15-8-14-13(7-12(15)18)19-10-20-14/h7-8,10-11H,5-6,9H2,1-4H3,(H,19,20)