tert-butyl 3-[3-[2-[(4-chloranylphenoxy)methyl]-6-methoxy-benzimidazol-1-yl]propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[3-[2-[(4-chloranylphenoxy)methyl]-6-methoxy-benzimidazol-1-yl]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[3-[2-[(4-chlorophenoxy)methyl]-6-methoxy-benzimidazol-1-yl]propyl]piperidine-1-carboxylate CAS Name: 3-[3-[2-[(4-chlorophenoxy)methyl]-6-methoxy-1-benzimidazolyl]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[3-[2-[(4-chlorophenoxy)methyl]-6-methoxybenzimidazol-1-yl]propyl]piperidine-1-carboxylate Traditional Name: 3-[3-[2-[(4-chlorophenoxy)methyl]-6-methoxy-benzimidazol-1-yl]propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H36ClN3O4 MolecularWeight: 514.05614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CCCN2C3=C(C=CC(=C3)OC)N=C2COC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CCCN2C3=C(C=CC(=C3)OC)N=C2COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H36ClN3O4/c1-28(2,3)36-27(33)31-15-5-7-20(18-31)8-6-16-32-25-17-23(34-4)13-14-24(25)30-26(32)19-35-22-11-9-21(29)10-12-22/h9-14,17,20H,5-8,15-16,18-19H2,1-4H3