4-azido-1-[2,6-bis(fluoranyl)phenyl]-4-(4-bromophenyl)butan-1-one

Systemtic Name: 4-azido-1-[2,6-bis(fluoranyl)phenyl]-4-(4-bromophenyl)butan-1-one Openeye Name: 4-azido-4-(4-bromophenyl)-1-(2,6-difluorophenyl)butan-1-one CAS Name: 4-azido-4-(4-bromophenyl)-1-(2,6-difluorophenyl)-1-butanone IUPAC Name: 4-azido-4-(4-bromophenyl)-1-(2,6-difluorophenyl)butan-1-one Traditional Name: 4-azido-4-(4-bromophenyl)-1-(2,6-difluorophenyl)butan-1-one Formula: C16H12BrF2N3O MolecularWeight: 380.186786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)C(=O)CCC(C2=CC=C(C=C2)Br)N=[N+]=[N-])F

Isomeric SMILES

C1=CC(=C(C(=C1)F)C(=O)CCC(C2=CC=C(C=C2)Br)N=[N+]=[N-])F

InChI

InChI=1S/C16H12BrF2N3O/c17-11-6-4-10(5-7-11)14(21-22-20)8-9-15(23)16-12(18)2-1-3-13(16)19/h1-7,14H,8-9H2