3-[[4-[6-(dimethylamino)hexoxycarbonyl]phenyl]methyl]-2-ethoxy-benzimidazole-5-carboxylic acid

Systemtic Name: 3-[[4-[6-(dimethylamino)hexoxycarbonyl]phenyl]methyl]-2-ethoxy-benzimidazole-5-carboxylic acid Openeye Name: 3-[[4-[6-(dimethylamino)hexoxycarbonyl]phenyl]methyl]-2-ethoxy-benzimidazole-5-carboxylic acid CAS Name: 3-[[4-[6-(dimethylamino)hexoxy-oxomethyl]phenyl]methyl]-2-ethoxy-5-benzimidazolecarboxylic acid IUPAC Name: 3-[[4-[6-(dimethylamino)hexoxycarbonyl]phenyl]methyl]-2-ethoxybenzimidazole-5-carboxylic acid Traditional Name: 3-[4-[6-(dimethylamino)hexoxycarbonyl]benzyl]-2-ethoxy-benzimidazole-5-carboxylic acid Formula: C26H33N3O5 MolecularWeight: 467.55732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)OCCCCCCN(C)C)C=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)OCCCCCCN(C)C)C=C(C=C2)C(=O)O

InChI

InChI=1S/C26H33N3O5/c1-4-33-26-27-22-14-13-21(24(30)31)17-23(22)29(26)18-19-9-11-20(12-10-19)25(32)34-16-8-6-5-7-15-28(2)3/h9-14,17H,4-8,15-16,18H2,1-3H3,(H,30,31)