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

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-nitro-phenyl)acrylamide Formula: C17H14N2O5 MolecularWeight: 326.30346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H14N2O5/c1-11-8-13(19(21)22)4-5-14(11)18-17(20)7-3-12-2-6-15-16(9-12)24-10-23-15/h2-9H,10H2,1H3,(H,18,20)/b7-3+