phenyl 4-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: phenyl 4-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: phenyl 4-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 4-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid phenyl ester IUPAC Name: phenyl 4-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 4-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid phenyl ester Formula: C23H18F3NO3 MolecularWeight: 413.38913

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2CN1C(=O)OC3=CC=CC=C3)OC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1C(C2=CC=CC=C2CN1C(=O)OC3=CC=CC=C3)OC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H18F3NO3/c24-23(25,26)17-10-12-19(13-11-17)29-21-15-27(14-16-6-4-5-9-20(16)21)22(28)30-18-7-2-1-3-8-18/h1-13,21H,14-15H2