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

Systemtic Name: tert-butyl 2-[3-[2-[(4-chloranylphenoxy)methyl]-6-methoxy-benzimidazol-1-yl]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 2-[3-[2-[(4-chlorophenoxy)methyl]-6-methoxy-benzimidazol-1-yl]propyl]piperidine-1-carboxylate CAS Name: 2-[3-[2-[(4-chlorophenoxy)methyl]-6-methoxy-1-benzimidazolyl]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[2-[(4-chlorophenoxy)methyl]-6-methoxybenzimidazol-1-yl]propyl]piperidine-1-carboxylate Traditional Name: 2-[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)N1CCCCC1CCCN2C3=C(C=CC(=C3)OC)N=C2COC4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCC1CCCN2C3=C(C=CC(=C3)OC)N=C2COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H36ClN3O4/c1-28(2,3)36-27(33)31-16-6-5-8-21(31)9-7-17-32-25-18-23(34-4)14-15-24(25)30-26(32)19-35-22-12-10-20(29)11-13-22/h10-15,18,21H,5-9,16-17,19H2,1-4H3