7-oxidanyl-1-[tris(bromanyl)methylsulfonyl]-2H-isoquinolin-3-one

Systemtic Name: 7-oxidanyl-1-[tris(bromanyl)methylsulfonyl]-2H-isoquinolin-3-one Openeye Name: 7-hydroxy-1-(tribromomethylsulfonyl)-2H-isoquinolin-3-one CAS Name: 7-hydroxy-1-(tribromomethylsulfonyl)-2H-isoquinolin-3-one IUPAC Name: 7-hydroxy-1-(tribromomethylsulfonyl)-2H-isoquinolin-3-one Traditional Name: 7-hydroxy-1-(tribromomethylsulfonyl)-3-isoquinolone Formula: C10H6Br3NO4S MolecularWeight: 475.93594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C(NC(=O)C=C21)S(=O)(=O)C(Br)(Br)Br)O

Isomeric SMILES

C1=CC(=CC2=C(NC(=O)C=C21)S(=O)(=O)C(Br)(Br)Br)O

InChI

InChI=1S/C10H6Br3NO4S/c11-10(12,13)19(17,18)9-7-4-6(15)2-1-5(7)3-8(16)14-9/h1-4,15H,(H,14,16)