(E)-2-cyano-N-(4-methoxyphenyl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4-methoxyphenyl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)-N-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-hydroxy-3-nitrophenyl)-N-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-hydroxy-3-nitrophenyl)-N-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)-N-(4-methoxyphenyl)acrylamide Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13N3O5/c1-25-14-5-3-13(4-6-14)19-17(22)12(10-18)8-11-2-7-16(21)15(9-11)20(23)24/h2-9,21H,1H3,(H,19,22)/b12-8+