4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoranyl-benzoate

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoranyl-benzoate Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoro-benzoate CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluorobenzoate IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluorobenzoate Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-fluoro-benzoate Formula: C16H13FNO2- MolecularWeight: 270.278323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(=O)[O-])F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(=O)[O-])F

InChI

InChI=1S/C16H14FNO2/c17-14-9-12(16(19)20)5-6-15(14)18-8-7-11-3-1-2-4-13(11)10-18/h1-6,9H,7-8,10H2,(H,19,20)/p-1