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

Systemtic Name: (E)-N-(3-chlorophenyl)-2-cyano-3-(3-nitro-4-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-N-(3-chlorophenyl)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-N-(3-chlorophenyl)-2-cyano-3-(4-hydroxy-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(3-chlorophenyl)-2-cyano-3-(4-hydroxy-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(3-chlorophenyl)-2-cyano-3-(4-hydroxy-3-nitro-phenyl)acrylamide Formula: C16H10ClN3O4 MolecularWeight: 343.7213

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10ClN3O4/c17-12-2-1-3-13(8-12)19-16(22)11(9-18)6-10-4-5-15(21)14(7-10)20(23)24/h1-8,21H,(H,19,22)/b11-6+