N5-[2,2,2-tris(fluoranyl)ethyl]isoquinoline-5,8-diamine

Systemtic Name: N5-[2,2,2-tris(fluoranyl)ethyl]isoquinoline-5,8-diamine Openeye Name: N5-(2,2,2-trifluoroethyl)isoquinoline-5,8-diamine CAS Name: N5-(2,2,2-trifluoroethyl)isoquinoline-5,8-diamine IUPAC Name: 5-N-(2,2,2-trifluoroethyl)isoquinoline-5,8-diamine Traditional Name: (8-amino-5-isoquinolyl)-(2,2,2-trifluoroethyl)amine Formula: C11H10F3N3 MolecularWeight: 241.21241

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CN=CC2=C1N)NCC(F)(F)F

Isomeric SMILES

C1=CC(=C2C=CN=CC2=C1N)NCC(F)(F)F

InChI

InChI=1S/C11H10F3N3/c12-11(13,14)6-17-10-2-1-9(15)8-5-16-4-3-7(8)10/h1-5,17H,6,15H2