ethyl 4-[bis(4-fluorophenyl)methylidene]azepane-1-carboxylate

Systemtic Name: ethyl 4-[bis(4-fluorophenyl)methylidene]azepane-1-carboxylate Openeye Name: ethyl 4-[bis(4-fluorophenyl)methylene]azepane-1-carboxylate CAS Name: 4-[bis(4-fluorophenyl)methylidene]-1-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[bis(4-fluorophenyl)methylidene]azepane-1-carboxylate Traditional Name: 4-[bis(4-fluorophenyl)methylene]azepane-1-carboxylic acid ethyl ester Formula: C22H23F2NO2 MolecularWeight: 371.420326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CC1

Isomeric SMILES

CCOC(=O)N1CCCC(=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)CC1

InChI

InChI=1S/C22H23F2NO2/c1-2-27-22(26)25-14-3-4-16(13-15-25)21(17-5-9-19(23)10-6-17)18-7-11-20(24)12-8-18/h5-12H,2-4,13-15H2,1H3