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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1C3CCOCC3)C=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)C1=NC2=C(N1C3CCOCC3)C=CC(=C2)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-10(2)15-17-13-9-11(16(19)20)3-4-14(13)18(15)12-5-7-21-8-6-12/h3-4,9-10,12H,5-8H2,1-2H3,(H,19,20)