(E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3,4-dimethoxyphenyl)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)acrylamide Formula: C19H17N3O7 MolecularWeight: 399.35418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(=CC2=CC(=C(C(=C2)OC)O)[N+](=O)[O-])C#N)OC

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O7/c1-27-15-5-4-13(9-16(15)28-2)21-19(24)12(10-20)6-11-7-14(22(25)26)18(23)17(8-11)29-3/h4-9,23H,1-3H3,(H,21,24)/b12-6+