3-bromanyl-5-nitro-1H-isochromen-4-one

Systemtic Name: 3-bromanyl-5-nitro-1H-isochromen-4-one Openeye Name: 3-bromo-5-nitro-isochroman-4-one CAS Name: 3-bromo-5-nitro-3,4-dihydro-1H-2-benzopyran-4-one IUPAC Name: 3-bromo-5-nitro-1H-isochromen-4-one Traditional Name: 3-bromo-5-nitro-isochroman-4-one Formula: C9H6BrNO4 MolecularWeight: 272.05224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)C(O1)Br

Isomeric SMILES

C1C2=C(C(=CC=C2)[N+](=O)[O-])C(=O)C(O1)Br

InChI

InChI=1S/C9H6BrNO4/c10-9-8(12)7-5(4-15-9)2-1-3-6(7)11(13)14/h1-3,9H,4H2