(E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethyl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethyl-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethyl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-ethyl-3-nitro-phenyl)acrylamide Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5/c1-2-14-4-3-13(10-17(14)23(25)26)9-15(12-21)20(24)22-16-5-6-18-19(11-16)28-8-7-27-18/h3-6,9-11H,2,7-8H2,1H3,(H,22,24)/b15-9+