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

Systemtic Name: 7-[3-(4-ethanoyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 7-[3-(4-acetyl-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-hydroxy-3-nitro-chromen-4-one CAS Name: 7-[3-(4-acetyl-2-propylphenoxy)-2-hydroxypropoxy]-2-hydroxy-3-nitro-1-benzopyran-4-one IUPAC Name: 7-[3-(4-acetyl-2-propylphenoxy)-2-hydroxypropoxy]-2-hydroxy-3-nitrochromen-4-one Traditional Name: 7-[3-(4-acetyl-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-hydroxy-3-nitro-chromone Formula: C23H23NO9 MolecularWeight: 457.43002

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C(=O)C)OCC(COC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])O

Isomeric SMILES

CCCC1=C(C=CC(=C1)C(=O)C)OCC(COC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])O

InChI

InChI=1S/C23H23NO9/c1-3-4-15-9-14(13(2)25)5-8-19(15)32-12-16(26)11-31-17-6-7-18-20(10-17)33-23(28)21(22(18)27)24(29)30/h5-10,16,26,28H,3-4,11-12H2,1-2H3