(E)-5-(3-methyl-6-nitro-2H-1,4-benzodioxin-3-yl)pent-3-en-2-one

Systemtic Name: (E)-5-(3-methyl-6-nitro-2H-1,4-benzodioxin-3-yl)pent-3-en-2-one Openeye Name: (E)-5-(3-methyl-6-nitro-2H-1,4-benzodioxin-3-yl)pent-3-en-2-one CAS Name: (E)-5-(3-methyl-6-nitro-2H-1,4-benzodioxin-3-yl)-3-penten-2-one IUPAC Name: (E)-5-(3-methyl-6-nitro-2H-1,4-benzodioxin-3-yl)pent-3-en-2-one Traditional Name: (E)-5-(3-methyl-6-nitro-2H-1,4-benzodioxin-3-yl)pent-3-en-2-one Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CCC1(COC2=C(O1)C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(=O)/C=C/CC1(COC2=C(O1)C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H15NO5/c1-10(16)4-3-7-14(2)9-19-12-6-5-11(15(17)18)8-13(12)20-14/h3-6,8H,7,9H2,1-2H3/b4-3+