ethyl 1-[[1-(4-fluoranylbutyl)benzimidazol-2-yl]methyl]-3-methoxy-2-oxidanylidene-quinoline-4-carboxylate

Systemtic Name: ethyl 1-[[1-(4-fluoranylbutyl)benzimidazol-2-yl]methyl]-3-methoxy-2-oxidanylidene-quinoline-4-carboxylate Openeye Name: ethyl 1-[[1-(4-fluorobutyl)benzimidazol-2-yl]methyl]-3-methoxy-2-oxo-quinoline-4-carboxylate CAS Name: 1-[[1-(4-fluorobutyl)-2-benzimidazolyl]methyl]-3-methoxy-2-oxo-4-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[1-(4-fluorobutyl)benzimidazol-2-yl]methyl]-3-methoxy-2-oxoquinoline-4-carboxylate Traditional Name: 1-[[1-(4-fluorobutyl)benzimidazol-2-yl]methyl]-2-keto-3-methoxy-cinchoninic acid ethyl ester Formula: C25H26FN3O4 MolecularWeight: 451.490043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)N(C2=CC=CC=C21)CC3=NC4=CC=CC=C4N3CCCCF)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=O)N(C2=CC=CC=C21)CC3=NC4=CC=CC=C4N3CCCCF)OC

InChI

InChI=1S/C25H26FN3O4/c1-3-33-25(31)22-17-10-4-6-12-19(17)29(24(30)23(22)32-2)16-21-27-18-11-5-7-13-20(18)28(21)15-9-8-14-26/h4-7,10-13H,3,8-9,14-16H2,1-2H3