4-(7-fluoranyl-2-phenyl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethyl-aniline

Systemtic Name: 4-(7-fluoranyl-2-phenyl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethyl-aniline Openeye Name: 4-(7-fluoro-2-phenyl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethyl-aniline CAS Name: 4-(7-fluoro-2-phenyl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethylaniline IUPAC Name: 4-(7-fluoro-2-phenyl-4H-1,3,4-benzotriazepin-5-yl)-N,N-dimethylaniline Traditional Name: [4-(7-fluoro-2-phenyl-4H-1,3,4-benzotriazepin-5-yl)phenyl]-dimethyl-amine Formula: C22H19FN4 MolecularWeight: 358.411463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CC=C4)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=CC=C4)F

InChI

InChI=1S/C22H19FN4/c1-27(2)18-11-8-15(9-12-18)21-19-14-17(23)10-13-20(19)24-22(26-25-21)16-6-4-3-5-7-16/h3-14,25H,1-2H3