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

Systemtic Name: 7-[3-(4-ethanoyl-3-oxidanyl-phenoxy)propoxy]-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 7-[3-(4-acetyl-3-hydroxy-phenoxy)propoxy]-2-hydroxy-3-nitro-chromen-4-one CAS Name: 7-[3-(4-acetyl-3-hydroxyphenoxy)propoxy]-2-hydroxy-3-nitro-1-benzopyran-4-one IUPAC Name: 7-[3-(4-acetyl-3-hydroxyphenoxy)propoxy]-2-hydroxy-3-nitrochromen-4-one Traditional Name: 7-[3-(4-acetyl-3-hydroxy-phenoxy)propoxy]-2-hydroxy-3-nitro-chromone Formula: C20H17NO9 MolecularWeight: 415.35028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])O

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)OCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])O

InChI

InChI=1S/C20H17NO9/c1-11(22)14-5-3-12(9-16(14)23)28-7-2-8-29-13-4-6-15-17(10-13)30-20(25)18(19(15)24)21(26)27/h3-6,9-10,23,25H,2,7-8H2,1H3