pentyl 2-oxidanylidene-1,3-dihydrobenzimidazole-5-carboxylate

Systemtic Name: pentyl 2-oxidanylidene-1,3-dihydrobenzimidazole-5-carboxylate Openeye Name: pentyl 2-oxo-1,3-dihydrobenzimidazole-5-carboxylate CAS Name: 2-oxo-1,3-dihydrobenzimidazole-5-carboxylic acid pentyl ester IUPAC Name: pentyl 2-oxo-1,3-dihydrobenzimidazole-5-carboxylate Traditional Name: 2-keto-1,3-dihydrobenzimidazole-5-carboxylic acid amyl ester Formula: C13H16N2O3 MolecularWeight: 248.27774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC2=C(C=C1)NC(=O)N2

Isomeric SMILES

CCCCCOC(=O)C1=CC2=C(C=C1)NC(=O)N2

InChI

InChI=1S/C13H16N2O3/c1-2-3-4-7-18-12(16)9-5-6-10-11(8-9)15-13(17)14-10/h5-6,8H,2-4,7H2,1H3,(H2,14,15,17)