4-[(2-butyl-6-morpholin-4-ylcarbonyl-benzimidazol-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(2-butyl-6-morpholin-4-ylcarbonyl-benzimidazol-1-yl)methyl]benzoic acid Openeye Name: 4-[[2-butyl-6-(morpholine-4-carbonyl)benzimidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-butyl-6-[4-morpholinyl(oxo)methyl]-1-benzimidazolyl]methyl]benzoic acid IUPAC Name: 4-[[2-butyl-6-(morpholine-4-carbonyl)benzimidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-butyl-6-(morpholine-4-carbonyl)benzimidazol-1-yl]methyl]benzoic acid Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)N4CCOCC4

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C(=O)O)C=C(C=C2)C(=O)N4CCOCC4

InChI

InChI=1S/C24H27N3O4/c1-2-3-4-22-25-20-10-9-19(23(28)26-11-13-31-14-12-26)15-21(20)27(22)16-17-5-7-18(8-6-17)24(29)30/h5-10,15H,2-4,11-14,16H2,1H3,(H,29,30)