3-(fluoranylmethyl)-N-(3-methoxypropyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonamide

Systemtic Name: 3-(fluoranylmethyl)-N-(3-methoxypropyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonamide Openeye Name: 3-(fluoromethyl)-N-(3-methoxypropyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide CAS Name: 3-(fluoromethyl)-N-(3-methoxypropyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide IUPAC Name: 3-(fluoromethyl)-N-(3-methoxypropyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonamide Traditional Name: 3-(fluoromethyl)-1-keto-N-(3-methoxypropyl)-3,4-dihydro-2H-isoquinoline-7-sulfonamide Formula: C14H19FN2O4S MolecularWeight: 330.375063

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNS(=O)(=O)C1=CC2=C(CC(NC2=O)CF)C=C1

Isomeric SMILES

COCCCNS(=O)(=O)C1=CC2=C(CC(NC2=O)CF)C=C1

InChI

InChI=1S/C14H19FN2O4S/c1-21-6-2-5-16-22(19,20)12-4-3-10-7-11(9-15)17-14(18)13(10)8-12/h3-4,8,11,16H,2,5-7,9H2,1H3,(H,17,18)