N-[[4-(benzotriazol-1-yl)-3-fluoranyl-phenyl]methyl]cyclopropanamine

Systemtic Name: N-[[4-(benzotriazol-1-yl)-3-fluoranyl-phenyl]methyl]cyclopropanamine Openeye Name: N-[[4-(benzotriazol-1-yl)-3-fluoro-phenyl]methyl]cyclopropanamine CAS Name: N-[[4-(1-benzotriazolyl)-3-fluorophenyl]methyl]cyclopropanamine IUPAC Name: N-[[4-(benzotriazol-1-yl)-3-fluorophenyl]methyl]cyclopropanamine Traditional Name: [4-(benzotriazol-1-yl)-3-fluoro-benzyl]-cyclopropyl-amine Formula: C16H15FN4 MolecularWeight: 282.315503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCC2=CC(=C(C=C2)N3C4=CC=CC=C4N=N3)F

Isomeric SMILES

C1CC1NCC2=CC(=C(C=C2)N3C4=CC=CC=C4N=N3)F

InChI

InChI=1S/C16H15FN4/c17-13-9-11(10-18-12-6-7-12)5-8-15(13)21-16-4-2-1-3-14(16)19-20-21/h1-5,8-9,12,18H,6-7,10H2