(E)-N-(2-chloranyl-5-nitro-phenyl)-3-[2-(2-phenoxyethanoyl)hydrazinyl]but-2-enamide

Systemtic Name: (E)-N-(2-chloranyl-5-nitro-phenyl)-3-[2-(2-phenoxyethanoyl)hydrazinyl]but-2-enamide Openeye Name: (E)-N-(2-chloro-5-nitro-phenyl)-3-[2-(2-phenoxyacetyl)hydrazino]but-2-enamide CAS Name: (E)-N-(2-chloro-5-nitrophenyl)-3-[(1-oxo-2-phenoxyethyl)hydrazo]-2-butenamide IUPAC Name: (E)-N-(2-chloro-5-nitrophenyl)-3-[2-(2-phenoxyacetyl)hydrazinyl]but-2-enamide Traditional Name: (E)-N-(2-chloro-5-nitro-phenyl)-3-[N'-(2-phenoxyacetyl)hydrazino]but-2-enamide Formula: C18H17ClN4O5 MolecularWeight: 404.80438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)NNC(=O)COC2=CC=CC=C2

Isomeric SMILES

C/C(=C\C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)/NNC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C18H17ClN4O5/c1-12(21-22-18(25)11-28-14-5-3-2-4-6-14)9-17(24)20-16-10-13(23(26)27)7-8-15(16)19/h2-10,21H,11H2,1H3,(H,20,24)(H,22,25)/b12-9+