3-(fluoranylmethyl)-N-(4-phenylbutyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

Systemtic Name: 3-(fluoranylmethyl)-N-(4-phenylbutyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Openeye Name: 3-(fluoromethyl)-N-(4-phenylbutyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide CAS Name: 3-(fluoromethyl)-N-(4-phenylbutyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide IUPAC Name: 3-(fluoromethyl)-N-(4-phenylbutyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Traditional Name: 3-(fluoromethyl)-N-(4-phenylbutyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Formula: C20H25FN2O2S MolecularWeight: 376.488103

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C1C=CC(=C2)S(=O)(=O)NCCCCC3=CC=CC=C3)CF

Isomeric SMILES

C1C(NCC2=C1C=CC(=C2)S(=O)(=O)NCCCCC3=CC=CC=C3)CF

InChI

InChI=1S/C20H25FN2O2S/c21-14-19-12-17-9-10-20(13-18(17)15-22-19)26(24,25)23-11-5-4-8-16-6-2-1-3-7-16/h1-3,6-7,9-10,13,19,22-23H,4-5,8,11-12,14-15H2