2-(2-fluoranylphenoxy)ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

Systemtic Name: 2-(2-fluoranylphenoxy)ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Openeye Name: 2-(2-fluorophenoxy)ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoic acid 2-(2-fluorophenoxy)ethyl ester IUPAC Name: 2-(2-fluorophenoxy)ethyl 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoic acid 2-(2-fluorophenoxy)ethyl ester Formula: C24H22FNO5S MolecularWeight: 455.498583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCCOC4=CC=CC=C4F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)OCCOC4=CC=CC=C4F

InChI

InChI=1S/C24H22FNO5S/c25-22-10-3-4-11-23(22)30-14-15-31-24(27)19-8-5-9-21(16-19)32(28,29)26-13-12-18-6-1-2-7-20(18)17-26/h1-11,16H,12-15,17H2