(3E)-3-[[3-ethoxy-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]methylidene]chromen-4-one

Systemtic Name: (3E)-3-[[3-ethoxy-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]methylidene]chromen-4-one Openeye Name: (3E)-3-[[3-ethoxy-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]methylene]chroman-4-one CAS Name: (3E)-3-[[3-ethoxy-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]methylidene]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3E)-3-[[3-ethoxy-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]methylidene]chromen-4-one Traditional Name: (3E)-3-[3-ethoxy-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]benzylidene]chroman-4-one Formula: C27H23NO8 MolecularWeight: 489.47342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2COC3=CC=CC=C3C2=O)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/2\COC3=CC=CC=C3C2=O)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5

InChI

InChI=1S/C27H23NO8/c1-2-33-25-10-17(9-18-14-34-23-6-4-3-5-22(23)26(18)29)7-8-24(25)35-15-20-12-21(28(30)31)11-19-13-32-16-36-27(19)20/h3-12H,2,13-16H2,1H3/b18-9+