tert-butyl 4-[3-[2-[(4-chloranylphenoxy)methyl]-4-propyl-benzimidazol-1-yl]propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[2-[(4-chloranylphenoxy)methyl]-4-propyl-benzimidazol-1-yl]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-[2-[(4-chlorophenoxy)methyl]-4-propyl-benzimidazol-1-yl]propyl]piperidine-1-carboxylate CAS Name: 4-[3-[2-[(4-chlorophenoxy)methyl]-4-propyl-1-benzimidazolyl]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[2-[(4-chlorophenoxy)methyl]-4-propylbenzimidazol-1-yl]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[2-[(4-chlorophenoxy)methyl]-4-propyl-benzimidazol-1-yl]propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H40ClN3O3 MolecularWeight: 526.1099

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCCC4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=C2C(=CC=C1)N(C(=N2)COC3=CC=C(C=C3)Cl)CCCC4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H40ClN3O3/c1-5-8-23-10-6-11-26-28(23)32-27(21-36-25-14-12-24(31)13-15-25)34(26)18-7-9-22-16-19-33(20-17-22)29(35)37-30(2,3)4/h6,10-15,22H,5,7-9,16-21H2,1-4H3