6-chloranyl-2-(3,4-dimethoxyphenyl)-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one

Systemtic Name: 6-chloranyl-2-(3,4-dimethoxyphenyl)-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one Openeye Name: 6-chloro-2-(3,4-dimethoxyphenyl)-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one CAS Name: 6-chloro-2-(3,4-dimethoxyphenyl)-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-1-benzopyran-4-one IUPAC Name: 6-chloro-2-(3,4-dimethoxyphenyl)-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one Traditional Name: 6-chloro-2-(3,4-dimethoxyphenyl)-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromone Formula: C26H20ClNO9 MolecularWeight: 525.8913

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5)OC

InChI

InChI=1S/C26H20ClNO9/c1-32-21-5-3-14(9-22(21)33-2)25-26(23(29)19-10-17(27)4-6-20(19)37-25)35-12-16-8-18(28(30)31)7-15-11-34-13-36-24(15)16/h3-10H,11-13H2,1-2H3