(E)-N-ethyl-N-(2-methylprop-2-enyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-(2-oxidanylidenepyridin-1-yl)prop-2-enamide

Systemtic Name: (E)-N-ethyl-N-(2-methylprop-2-enyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-(2-oxidanylidenepyridin-1-yl)prop-2-enamide Openeye Name: (E)-N-ethyl-N-(2-methylallyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-(2-oxo-1-pyridyl)prop-2-enamide CAS Name: (E)-N-ethyl-N-(2-methylprop-2-enyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-(2-oxo-1-pyridinyl)-2-propenamide IUPAC Name: (E)-N-ethyl-N-(2-methylprop-2-enyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-(2-oxopyridin-1-yl)prop-2-enamide Traditional Name: (E)-N-ethyl-2-(2-keto-1-pyridyl)-N-(2-methylallyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)C(=CC1=CC2=C(C=C1[N+](=O)[O-])OCO2)N3C=CC=CC3=O

Isomeric SMILES

CCN(CC(=C)C)C(=O)/C(=C\C1=CC2=C(C=C1[N+](=O)[O-])OCO2)/N3C=CC=CC3=O

InChI

InChI=1S/C21H21N3O6/c1-4-22(12-14(2)3)21(26)17(23-8-6-5-7-20(23)25)9-15-10-18-19(30-13-29-18)11-16(15)24(27)28/h5-11H,2,4,12-13H2,1,3H3/b17-9+