(E)-2-cyano-3-(3-methoxy-5-nitro-2-oxidanyl-phenyl)-N,N-dimethyl-prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-methoxy-5-nitro-2-oxidanyl-phenyl)-N,N-dimethyl-prop-2-enamide Openeye Name: (E)-2-cyano-3-(2-hydroxy-3-methoxy-5-nitro-phenyl)-N,N-dimethyl-prop-2-enamide CAS Name: (E)-2-cyano-3-(2-hydroxy-3-methoxy-5-nitrophenyl)-N,N-dimethyl-2-propenamide IUPAC Name: (E)-2-cyano-3-(2-hydroxy-3-methoxy-5-nitrophenyl)-N,N-dimethylprop-2-enamide Traditional Name: (E)-2-cyano-3-(2-hydroxy-3-methoxy-5-nitro-phenyl)-N,N-dimethyl-acrylamide Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(=CC1=CC(=CC(=C1O)OC)[N+](=O)[O-])C#N

Isomeric SMILES

CN(C)C(=O)/C(=C/C1=CC(=CC(=C1O)OC)[N+](=O)[O-])/C#N

InChI

InChI=1S/C13H13N3O5/c1-15(2)13(18)9(7-14)4-8-5-10(16(19)20)6-11(21-3)12(8)17/h4-6,17H,1-3H3/b9-4+