4-[[6-(diethylcarbamoyl)-2-ethoxy-benzimidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[6-(diethylcarbamoyl)-2-ethoxy-benzimidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[6-(diethylcarbamoyl)-2-ethoxy-benzimidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[6-[diethylamino(oxo)methyl]-2-ethoxy-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 4-[[6-(diethylcarbamoyl)-2-ethoxybenzimidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[6-(diethylcarbamoyl)-2-ethoxy-benzimidazol-1-yl]methyl]benzoic acid Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC=C(C=C3)C(=O)O)OCC

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)N=C(N2CC3=CC=C(C=C3)C(=O)O)OCC

InChI

InChI=1S/C22H25N3O4/c1-4-24(5-2)20(26)17-11-12-18-19(13-17)25(22(23-18)29-6-3)14-15-7-9-16(10-8-15)21(27)28/h7-13H,4-6,14H2,1-3H3,(H,27,28)