6-methyl-8-nitro-2-(3-nitro-4-oxidanyl-phenyl)-3-oxidanyl-chromen-4-one

Systemtic Name: 6-methyl-8-nitro-2-(3-nitro-4-oxidanyl-phenyl)-3-oxidanyl-chromen-4-one Openeye Name: 3-hydroxy-2-(4-hydroxy-3-nitro-phenyl)-6-methyl-8-nitro-chromen-4-one CAS Name: 3-hydroxy-2-(4-hydroxy-3-nitrophenyl)-6-methyl-8-nitro-1-benzopyran-4-one IUPAC Name: 3-hydroxy-2-(4-hydroxy-3-nitrophenyl)-6-methyl-8-nitrochromen-4-one Traditional Name: 3-hydroxy-2-(4-hydroxy-3-nitro-phenyl)-6-methyl-8-nitro-chromone Formula: C16H10N2O8 MolecularWeight: 358.2592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=O)C(=C(O2)C3=CC(=C(C=C3)O)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O8/c1-7-4-9-13(20)14(21)15(26-16(9)11(5-7)18(24)25)8-2-3-12(19)10(6-8)17(22)23/h2-6,19,21H,1H3