N-[[2-(benzotriazol-1-yl)-5-fluoranyl-phenyl]methyl]propan-1-amine

Systemtic Name: N-[[2-(benzotriazol-1-yl)-5-fluoranyl-phenyl]methyl]propan-1-amine Openeye Name: N-[[2-(benzotriazol-1-yl)-5-fluoro-phenyl]methyl]propan-1-amine CAS Name: N-[[2-(1-benzotriazolyl)-5-fluorophenyl]methyl]-1-propanamine IUPAC Name: N-[[2-(benzotriazol-1-yl)-5-fluorophenyl]methyl]propan-1-amine Traditional Name: [2-(benzotriazol-1-yl)-5-fluoro-benzyl]-propyl-amine Formula: C16H17FN4 MolecularWeight: 284.331383

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=C(C=CC(=C1)F)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CCCNCC1=C(C=CC(=C1)F)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H17FN4/c1-2-9-18-11-12-10-13(17)7-8-15(12)21-16-6-4-3-5-14(16)19-20-21/h3-8,10,18H,2,9,11H2,1H3