7-azanyl-2-[4-(4-fluorophenyl)phenyl]sulfonyl-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 7-azanyl-2-[4-(4-fluorophenyl)phenyl]sulfonyl-N-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 7-amino-2-[4-(4-fluorophenyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid CAS Name: 7-amino-2-[4-(4-fluorophenyl)phenyl]sulfonyl-N-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 7-amino-2-[4-(4-fluorophenyl)phenyl]sulfonyl-N-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 7-amino-2-[4-(4-fluorophenyl)phenyl]sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydroxamic acid Formula: C22H20FN3O4S MolecularWeight: 441.475303

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C1C=CC(=C2)N)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)C(=O)NO

Isomeric SMILES

C1C(N(CC2=C1C=CC(=C2)N)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)C(=O)NO

InChI

InChI=1S/C22H20FN3O4S/c23-18-6-1-14(2-7-18)15-4-9-20(10-5-15)31(29,30)26-13-17-11-19(24)8-3-16(17)12-21(26)22(27)25-28/h1-11,21,28H,12-13,24H2,(H,25,27)