N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]isoquinoline-5-sulfonamide Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]isoquinoline-5-sulfonamide CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-5-isoquinolinesulfonamide IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]isoquinoline-5-sulfonamide Traditional Name: N-(2-chloro-4-fluoro-benzyl)isoquinoline-5-sulfonamide Formula: C16H12ClFN2O2S MolecularWeight: 350.795083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)S(=O)(=O)NCC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H12ClFN2O2S/c17-15-8-13(18)5-4-12(15)10-20-23(21,22)16-3-1-2-11-9-19-7-6-14(11)16/h1-9,20H,10H2