(E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethyl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethyl-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethyl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(4-ethyl-3-nitro-phenyl)acrylamide Formula: C18H16N2O5 MolecularWeight: 340.33004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5/c1-2-13-5-6-14(10-15(13)20(22)23)19-18(21)8-4-12-3-7-16-17(9-12)25-11-24-16/h3-10H,2,11H2,1H3,(H,19,21)/b8-4+