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

Systemtic Name: N-(4-bromophenyl)-3-(fluoranylmethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Openeye Name: N-(4-bromophenyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide CAS Name: N-(4-bromophenyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide IUPAC Name: N-(4-bromophenyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Traditional Name: N-(4-bromophenyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Formula: C16H16BrFN2O2S MolecularWeight: 399.277843

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NCC2=C1C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Br)CF

Isomeric SMILES

C1C(NCC2=C1C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)Br)CF

InChI

InChI=1S/C16H16BrFN2O2S/c17-13-2-4-14(5-3-13)20-23(21,22)16-6-1-11-7-15(9-18)19-10-12(11)8-16/h1-6,8,15,19-20H,7,9-10H2