2-[5-fluoranyl-2-(trifluoromethyl)phenyl]carbonyl-N-phenethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide

Systemtic Name: 2-[5-fluoranyl-2-(trifluoromethyl)phenyl]carbonyl-N-phenethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Openeye Name: 2-[5-fluoro-2-(trifluoromethyl)benzoyl]-N-phenethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide CAS Name: 2-[[5-fluoro-2-(trifluoromethyl)phenyl]-oxomethyl]-N-phenethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide IUPAC Name: 2-[5-fluoro-2-(trifluoromethyl)benzoyl]-N-phenethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Traditional Name: 2-[5-fluoro-2-(trifluoromethyl)benzoyl]-N-phenethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Formula: C26H22F4N2O2 MolecularWeight: 470.458693

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=C(C=C2)C(=O)NCCC3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)F)C(F)(F)F

Isomeric SMILES

C1CN(CC2=C1C=C(C=C2)C(=O)NCCC3=CC=CC=C3)C(=O)C4=C(C=CC(=C4)F)C(F)(F)F

InChI

InChI=1S/C26H22F4N2O2/c27-21-8-9-23(26(28,29)30)22(15-21)25(34)32-13-11-18-14-19(6-7-20(18)16-32)24(33)31-12-10-17-4-2-1-3-5-17/h1-9,14-15H,10-13,16H2,(H,31,33)