1-(furan-2-ylmethyl)-2-propan-2-yl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-(furan-2-ylmethyl)-2-propan-2-yl-benzimidazole-5-carboxylic acid Openeye Name: 1-(2-furylmethyl)-2-isopropyl-benzimidazole-5-carboxylic acid CAS Name: 1-(2-furanylmethyl)-2-propan-2-yl-5-benzimidazolecarboxylic acid IUPAC Name: 1-(furan-2-ylmethyl)-2-propan-2-ylbenzimidazole-5-carboxylic acid Traditional Name: 1-(2-furfuryl)-2-isopropyl-benzimidazole-5-carboxylic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1CC3=CC=CO3)C=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)C1=NC2=C(N1CC3=CC=CO3)C=CC(=C2)C(=O)O

InChI

InChI=1S/C16H16N2O3/c1-10(2)15-17-13-8-11(16(19)20)5-6-14(13)18(15)9-12-4-3-7-21-12/h3-8,10H,9H2,1-2H3,(H,19,20)