6-(3-chloranylpropoxy)-1-(phenylmethyl)-5-(2,3,4-trimethoxyphenyl)benzimidazole

Systemtic Name: 6-(3-chloranylpropoxy)-1-(phenylmethyl)-5-(2,3,4-trimethoxyphenyl)benzimidazole Openeye Name: 1-benzyl-6-(3-chloropropoxy)-5-(2,3,4-trimethoxyphenyl)benzimidazole CAS Name: 6-(3-chloropropoxy)-1-(phenylmethyl)-5-(2,3,4-trimethoxyphenyl)benzimidazole IUPAC Name: 1-benzyl-6-(3-chloropropoxy)-5-(2,3,4-trimethoxyphenyl)benzimidazole Traditional Name: 1-benzyl-6-(3-chloropropoxy)-5-(2,3,4-trimethoxyphenyl)benzimidazole Formula: C26H27ClN2O4 MolecularWeight: 466.95658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=CC3=C(C=C2OCCCCl)N(C=N3)CC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=CC3=C(C=C2OCCCCl)N(C=N3)CC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C26H27ClN2O4/c1-30-23-11-10-19(25(31-2)26(23)32-3)20-14-21-22(15-24(20)33-13-7-12-27)29(17-28-21)16-18-8-5-4-6-9-18/h4-6,8-11,14-15,17H,7,12-13,16H2,1-3H3