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

Systemtic Name: tert-butyl 4-[3-[4-tert-butyl-2-[(4-chloranylphenoxy)methyl]benzimidazol-1-yl]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-[4-tert-butyl-2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]propyl]piperidine-1-carboxylate CAS Name: 4-[3-[4-tert-butyl-2-[(4-chlorophenoxy)methyl]-1-benzimidazolyl]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[4-tert-butyl-2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[4-tert-butyl-2-[(4-chlorophenoxy)methyl]benzimidazol-1-yl]propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C31H42ClN3O3 MolecularWeight: 540.13648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H42ClN3O3/c1-30(2,3)25-10-7-11-26-28(25)33-27(21-37-24-14-12-23(32)13-15-24)35(26)18-8-9-22-16-19-34(20-17-22)29(36)38-31(4,5)6/h7,10-15,22H,8-9,16-21H2,1-6H3