[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 1-(4-fluorophenyl)cyclobutane-1-carboxylate

Systemtic Name: [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 1-(4-fluorophenyl)cyclobutane-1-carboxylate Openeye Name: [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxo-propyl] 1-(4-fluorophenyl)cyclobutanecarboxylate CAS Name: 1-(4-fluorophenyl)-1-cyclobutanecarboxylic acid [3-cyano-3-(1,3-dimethyl-2-benzimidazolylidene)-2-oxopropyl] ester IUPAC Name: [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxopropyl] 1-(4-fluorophenyl)cyclobutane-1-carboxylate Traditional Name: 1-(4-fluorophenyl)cyclobutanecarboxylic acid [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-keto-propyl] ester Formula: C24H22FN3O3 MolecularWeight: 419.448183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)COC(=O)C3(CCC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)COC(=O)C3(CCC3)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C24H22FN3O3/c1-27-19-6-3-4-7-20(19)28(2)22(27)18(14-26)21(29)15-31-23(30)24(12-5-13-24)16-8-10-17(25)11-9-16/h3-4,6-11H,5,12-13,15H2,1-2H3