9-(5-nitrofuran-2-yl)-2,6,7-tris(oxidanyl)xanthen-3-one

Systemtic Name: 9-(5-nitrofuran-2-yl)-2,6,7-tris(oxidanyl)xanthen-3-one Openeye Name: 2,6,7-trihydroxy-9-(5-nitro-2-furyl)xanthen-3-one CAS Name: 2,6,7-trihydroxy-9-(5-nitro-2-furanyl)-3-xanthenone IUPAC Name: 2,6,7-trihydroxy-9-(5-nitrofuran-2-yl)xanthen-3-one Traditional Name: 2,6,7-trihydroxy-9-(5-nitro-2-furyl)fluorone Formula: C17H9NO8 MolecularWeight: 355.25526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)[N+](=O)[O-])C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O

Isomeric SMILES

C1=C(OC(=C1)[N+](=O)[O-])C2=C3C=C(C(=O)C=C3OC4=CC(=C(C=C42)O)O)O

InChI

InChI=1S/C17H9NO8/c19-9-3-7-14(5-11(9)21)25-15-6-12(22)10(20)4-8(15)17(7)13-1-2-16(26-13)18(23)24/h1-6,19-21H