3-fluoranyl-4-methoxy-N-[5-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]benzamide

Systemtic Name: 3-fluoranyl-4-methoxy-N-[5-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]benzamide Openeye Name: 3-fluoro-4-methoxy-N-[5-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]benzamide CAS Name: 3-fluoro-4-methoxy-N-[5-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]benzamide IUPAC Name: 3-fluoro-4-methoxy-N-[5-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]benzamide Traditional Name: 3-fluoro-4-methoxy-N-[5-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]benzamide Formula: C18H16F4N2O2 MolecularWeight: 368.325453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCNCC3=C2)C(F)(F)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCNCC3=C2)C(F)(F)F)F

InChI

InChI=1S/C18H16F4N2O2/c1-26-16-3-2-10(7-15(16)19)17(25)24-12-6-11-9-23-5-4-13(11)14(8-12)18(20,21)22/h2-3,6-8,23H,4-5,9H2,1H3,(H,24,25)