[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-methyl-1-phenyl-benzimidazole-5-carboxylate CAS Name: 2-methyl-1-phenyl-5-benzimidazolecarboxylic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-methyl-1-phenylbenzimidazole-5-carboxylate Traditional Name: 2-methyl-1-phenyl-benzimidazole-5-carboxylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C25H21FN2O3 MolecularWeight: 416.444243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCCCC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)C(=O)OCCCC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H21FN2O3/c1-17-27-22-16-19(11-14-23(22)28(17)21-6-3-2-4-7-21)25(30)31-15-5-8-24(29)18-9-12-20(26)13-10-18/h2-4,6-7,9-14,16H,5,8,15H2,1H3