1-(oxan-4-yl)-2-propyl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-(oxan-4-yl)-2-propyl-benzimidazole-5-carboxylic acid Openeye Name: 2-propyl-1-tetrahydropyran-4-yl-benzimidazole-5-carboxylic acid CAS Name: 1-(4-oxanyl)-2-propyl-5-benzimidazolecarboxylic acid IUPAC Name: 1-(oxan-4-yl)-2-propylbenzimidazole-5-carboxylic acid Traditional Name: 2-propyl-1-tetrahydropyran-4-yl-benzimidazole-5-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1C3CCOCC3)C=CC(=C2)C(=O)O

Isomeric SMILES

CCCC1=NC2=C(N1C3CCOCC3)C=CC(=C2)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-2-3-15-17-13-10-11(16(19)20)4-5-14(13)18(15)12-6-8-21-9-7-12/h4-5,10,12H,2-3,6-9H2,1H3,(H,19,20)