[4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: [4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: [4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenyl] 3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid [4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl] ester IUPAC Name: [4-[5-(trifluoromethyl)pyridin-2-yl]oxyphenyl] 3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid [4-[[5-(trifluoromethyl)-2-pyridyl]oxy]phenyl] ester Formula: C22H17F3N2O3 MolecularWeight: 414.37719

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)OC3=CC=C(C=C3)OC4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)OC3=CC=C(C=C3)OC4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H17F3N2O3/c23-22(24,25)17-5-10-20(26-13-17)29-18-6-8-19(9-7-18)30-21(28)27-12-11-15-3-1-2-4-16(15)14-27/h1-10,13H,11-12,14H2