(E)-N-(2-ethanoylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-(2-ethanoylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-(2-acetylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-(2-acetylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-(2-acetylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(2-acetylphenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C18H14N2O6 MolecularWeight: 354.31356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C18H14N2O6/c1-11(21)13-4-2-3-5-14(13)19-18(22)7-6-12-8-16-17(26-10-25-16)9-15(12)20(23)24/h2-9H,10H2,1H3,(H,19,22)/b7-6+