methyl 2-[(4-chloranylphenoxy)methyl]-3-(3-piperidin-4-ylpropyl)benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[(4-chloranylphenoxy)methyl]-3-(3-piperidin-4-ylpropyl)benzimidazole-5-carboxylate Openeye Name: methyl 2-[(4-chlorophenoxy)methyl]-3-[3-(4-piperidyl)propyl]benzimidazole-5-carboxylate CAS Name: 2-[(4-chlorophenoxy)methyl]-3-[3-(4-piperidinyl)propyl]-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-chlorophenoxy)methyl]-3-(3-piperidin-4-ylpropyl)benzimidazole-5-carboxylate Traditional Name: 2-[(4-chlorophenoxy)methyl]-3-[3-(4-piperidyl)propyl]benzimidazole-5-carboxylic acid methyl ester Formula: C24H28ClN3O3 MolecularWeight: 441.95042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(N2CCCC3CCNCC3)COC4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(N2CCCC3CCNCC3)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H28ClN3O3/c1-30-24(29)18-4-9-21-22(15-18)28(14-2-3-17-10-12-26-13-11-17)23(27-21)16-31-20-7-5-19(25)6-8-20/h4-9,15,17,26H,2-3,10-14,16H2,1H3