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

Systemtic Name: 7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-4-propyl-chromen-2-one Openeye Name: 7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-4-propyl-chromen-2-one CAS Name: 7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-4-propylchromen-2-one Traditional Name: 7-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-4-propyl-coumarin Formula: C21H19NO7 MolecularWeight: 397.37806

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C21H19NO7/c1-2-3-13-8-20(23)29-19-9-17(4-5-18(13)19)27-11-15-7-16(22(24)25)6-14-10-26-12-28-21(14)15/h4-9H,2-3,10-12H2,1H3