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

Systemtic Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(4-hydroxy-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(4-hydroxy-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)acrylamide Formula: C18H14N4O5 MolecularWeight: 366.32756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)O)[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)O)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H14N4O5/c1-11(23)20-14-3-5-15(6-4-14)21-18(25)13(10-19)8-12-2-7-17(24)16(9-12)22(26)27/h2-9,24H,1H3,(H,20,23)(H,21,25)/b13-8+