(E)-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(5-ethoxy-2-methyl-coumaran-6-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C21H20N2O7 MolecularWeight: 412.3927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)C=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)/C=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C21H20N2O7/c1-3-27-18-8-14-6-12(2)30-17(14)9-15(18)22-21(24)5-4-13-7-19-20(29-11-28-19)10-16(13)23(25)26/h4-5,7-10,12H,3,6,11H2,1-2H3,(H,22,24)/b5-4+