4-(5-ethoxycarbonyl-1-propyl-benzimidazol-2-yl)benzoic acid

Systemtic Name: 4-(5-ethoxycarbonyl-1-propyl-benzimidazol-2-yl)benzoic acid Openeye Name: 4-(5-ethoxycarbonyl-1-propyl-benzimidazol-2-yl)benzoic acid CAS Name: 4-(5-ethoxycarbonyl-1-propyl-2-benzimidazolyl)benzoic acid IUPAC Name: 4-(5-ethoxycarbonyl-1-propylbenzimidazol-2-yl)benzoic acid Traditional Name: 4-(5-carbethoxy-1-propyl-benzimidazol-2-yl)benzoic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H20N2O4/c1-3-11-22-17-10-9-15(20(25)26-4-2)12-16(17)21-18(22)13-5-7-14(8-6-13)19(23)24/h5-10,12H,3-4,11H2,1-2H3,(H,23,24)