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

Systemtic Name: (E)-2-cyano-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-N-prop-2-enyl-prop-2-enamide Openeye Name: (E)-N-allyl-2-cyano-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-N-prop-2-enyl-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-N-prop-2-enylprop-2-enamide Traditional Name: (E)-N-allyl-2-cyano-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)acrylamide Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)C(=O)NCC=C

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C(\C#N)/C(=O)NCC=C

InChI

InChI=1S/C14H13N3O5/c1-3-4-16-14(19)10(8-15)5-9-6-11(17(20)21)13(18)12(7-9)22-2/h3,5-7,18H,1,4H2,2H3,(H,16,19)/b10-5+