1-(oxolan-2-ylmethyl)-2-[1-(propanoylamino)ethyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-(oxolan-2-ylmethyl)-2-[1-(propanoylamino)ethyl]benzimidazole-5-carboxylic acid Openeye Name: 2-[1-(propanoylamino)ethyl]-1-(tetrahydrofuran-2-ylmethyl)benzimidazole-5-carboxylic acid CAS Name: 1-(2-oxolanylmethyl)-2-[1-(1-oxopropylamino)ethyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-(oxolan-2-ylmethyl)-2-[1-(propanoylamino)ethyl]benzimidazole-5-carboxylic acid Traditional Name: 2-(1-propionamidoethyl)-1-(tetrahydrofurfuryl)benzimidazole-5-carboxylic acid Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C)C1=NC2=C(N1CC3CCCO3)C=CC(=C2)C(=O)O

Isomeric SMILES

CCC(=O)NC(C)C1=NC2=C(N1CC3CCCO3)C=CC(=C2)C(=O)O

InChI

InChI=1S/C18H23N3O4/c1-3-16(22)19-11(2)17-20-14-9-12(18(23)24)6-7-15(14)21(17)10-13-5-4-8-25-13/h6-7,9,11,13H,3-5,8,10H2,1-2H3,(H,19,22)(H,23,24)