(E)-2-cyano-3-(4,5-dimethoxy-2-nitro-phenyl)-N-(2-phenoxyethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4,5-dimethoxy-2-nitro-phenyl)-N-(2-phenoxyethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4,5-dimethoxy-2-nitro-phenyl)-N-(2-phenoxyethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4,5-dimethoxy-2-nitrophenyl)-N-(2-phenoxyethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(4,5-dimethoxy-2-nitrophenyl)-N-(2-phenoxyethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4,5-dimethoxy-2-nitro-phenyl)-N-(2-phenoxyethyl)acrylamide Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C(=O)NCCOC2=CC=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C(=O)NCCOC2=CC=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H19N3O6/c1-27-18-11-14(17(23(25)26)12-19(18)28-2)10-15(13-21)20(24)22-8-9-29-16-6-4-3-5-7-16/h3-7,10-12H,8-9H2,1-2H3,(H,22,24)/b15-10+