1-chloranyl-N-piperidin-4-yl-isoquinolin-5-amine; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 1-chloranyl-N-piperidin-4-yl-isoquinolin-5-amine; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 1-chloro-N-(4-piperidyl)isoquinolin-5-amine; 2,2,2-trifluoroacetic acid CAS Name: 1-chloro-N-(4-piperidinyl)-5-isoquinolinamine; 2,2,2-trifluoroacetic acid IUPAC Name: 1-chloro-N-piperidin-4-ylisoquinolin-5-amine; 2,2,2-trifluoroacetic acid Traditional Name: (1-chloro-5-isoquinolyl)-(4-piperidyl)amine; 2,2,2-trifluoroacetic acid Formula: C16H17ClF3N3O2 MolecularWeight: 375.77329

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NC2=CC=CC3=C2C=CN=C3Cl.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CNCCC1NC2=CC=CC3=C2C=CN=C3Cl.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C14H16ClN3.C2HF3O2/c15-14-12-2-1-3-13(11(12)6-9-17-14)18-10-4-7-16-8-5-10;3-2(4,5)1(6)7/h1-3,6,9-10,16,18H,4-5,7-8H2;(H,6,7)