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

Systemtic Name: 7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-hydroxy-3-nitro-chromen-4-one CAS Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-hydroxy-3-nitro-1-benzopyran-4-one IUPAC Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-hydroxy-3-nitrochromen-4-one Traditional Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)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(=C1O)C(=O)C)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-]

InChI

InChI=1S/C23H23NO9/c1-3-5-16-18(9-8-15(13(2)25)21(16)26)32-11-4-10-31-14-6-7-17-19(12-14)33-23(28)20(22(17)27)24(29)30/h6-9,12,26,28H,3-5,10-11H2,1-2H3