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

Systemtic Name: N-phenethyl-2-[2-(trifluoromethyl)phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Openeye Name: N-phenethyl-2-[2-(trifluoromethyl)benzoyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide CAS Name: 2-[oxo-[2-(trifluoromethyl)phenyl]methyl]-N-phenethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide IUPAC Name: N-phenethyl-2-[2-(trifluoromethyl)benzoyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide Traditional Name: N-phenethyl-2-[2-(trifluoromethyl)benzoyl]-3,4-dihydro-1H-isoquinoline-6-carboxamide Formula: C26H23F3N2O2 MolecularWeight: 452.46823

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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=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CC2=C1C=C(C=C2)C(=O)NCCC3=CC=CC=C3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C26H23F3N2O2/c27-26(28,29)23-9-5-4-8-22(23)25(33)31-15-13-19-16-20(10-11-21(19)17-31)24(32)30-14-12-18-6-2-1-3-7-18/h1-11,16H,12-15,17H2,(H,30,32)