(2-azanyl-2-oxidanylidene-ethyl) 2-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]ethanoate Openeye Name: (2-amino-2-oxo-ethyl) 2-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetate CAS Name: 2-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetate Traditional Name: 2-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]acetic acid (2-amino-2-keto-ethyl) ester Formula: C19H19FN2O5S MolecularWeight: 406.427963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=CC=CC=C21)CC(=O)OCC(=O)N)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(C(C2=CC=CC=C21)CC(=O)OCC(=O)N)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN2O5S/c20-14-5-7-15(8-6-14)28(25,26)22-10-9-13-3-1-2-4-16(13)17(22)11-19(24)27-12-18(21)23/h1-8,17H,9-12H2,(H2,21,23)