2-(benzotriazol-1-ylmethyl)-5-fluoranyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(benzotriazol-1-ylmethyl)-5-fluoranyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(benzotriazol-1-ylmethyl)-5-fluoro-3,4-dihydro-1H-isoquinoline CAS Name: 2-(1-benzotriazolylmethyl)-5-fluoro-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(benzotriazol-1-ylmethyl)-5-fluoro-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(benzotriazol-1-ylmethyl)-5-fluoro-3,4-dihydro-1H-isoquinoline Formula: C16H15FN4 MolecularWeight: 282.315503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=CC=C2)F)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CN(CC2=C1C(=CC=C2)F)CN3C4=CC=CC=C4N=N3

InChI

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