1-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]propan-1-one Openeye Name: 1-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]propan-1-one CAS Name: 1-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]propan-1-one Traditional Name: 1-[4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]phenyl]propan-1-one Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C18H17NO6/c1-2-17(20)12-3-5-16(6-4-12)24-10-14-8-15(19(21)22)7-13-9-23-11-25-18(13)14/h3-8H,2,9-11H2,1H3