7-[2-(4-ethanoyl-6-nitro-3-oxidanyl-2-propyl-phenoxy)ethoxy]-3-nitro-2-oxidanyl-chromen-4-one

Systemtic Name: 7-[2-(4-ethanoyl-6-nitro-3-oxidanyl-2-propyl-phenoxy)ethoxy]-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 7-[2-(4-acetyl-3-hydroxy-6-nitro-2-propyl-phenoxy)ethoxy]-2-hydroxy-3-nitro-chromen-4-one CAS Name: 7-[2-(4-acetyl-3-hydroxy-6-nitro-2-propylphenoxy)ethoxy]-2-hydroxy-3-nitro-1-benzopyran-4-one IUPAC Name: 7-[2-(4-acetyl-3-hydroxy-6-nitro-2-propylphenoxy)ethoxy]-2-hydroxy-3-nitrochromen-4-one Traditional Name: 7-[2-(4-acetyl-3-hydroxy-6-nitro-2-propyl-phenoxy)ethoxy]-2-hydroxy-3-nitro-chromone Formula: C22H20N2O11 MolecularWeight: 488.401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=C1OCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])[N+](=O)[O-])C(=O)C)O

Isomeric SMILES

CCCC1=C(C(=CC(=C1OCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])[N+](=O)[O-])C(=O)C)O

InChI

InChI=1S/C22H20N2O11/c1-3-4-14-19(26)15(11(2)25)10-16(23(29)30)21(14)34-8-7-33-12-5-6-13-17(9-12)35-22(28)18(20(13)27)24(31)32/h5-6,9-10,26,28H,3-4,7-8H2,1-2H3