4-ethyl-7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-2-one

Systemtic Name: 4-ethyl-7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-2-one Openeye Name: 4-ethyl-7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-2-one CAS Name: 4-ethyl-7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-1-benzopyran-2-one IUPAC Name: 4-ethyl-7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-2-one Traditional Name: 4-ethyl-7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]coumarin Formula: C20H17NO7 MolecularWeight: 383.35148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

CCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C20H17NO7/c1-2-12-7-19(22)28-18-8-16(3-4-17(12)18)26-10-14-6-15(21(23)24)5-13-9-25-11-27-20(13)14/h3-8H,2,9-11H2,1H3