(E)-N-(2-chloranyl-5-nitro-phenyl)-3-[2-(2-methylphenyl)carbonylhydrazinyl]but-2-enamide

Systemtic Name: (E)-N-(2-chloranyl-5-nitro-phenyl)-3-[2-(2-methylphenyl)carbonylhydrazinyl]but-2-enamide Openeye Name: (E)-N-(2-chloro-5-nitro-phenyl)-3-[2-(2-methylbenzoyl)hydrazino]but-2-enamide CAS Name: (E)-N-(2-chloro-5-nitrophenyl)-3-[[(2-methylphenyl)-oxomethyl]hydrazo]-2-butenamide IUPAC Name: (E)-N-(2-chloro-5-nitrophenyl)-3-[2-(2-methylbenzoyl)hydrazinyl]but-2-enamide Traditional Name: (E)-N-(2-chloro-5-nitro-phenyl)-3-(N'-o-toluoylhydrazino)but-2-enamide Formula: C18H17ClN4O4 MolecularWeight: 388.80498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NNC(=CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NN/C(=C/C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)/C

InChI

InChI=1S/C18H17ClN4O4/c1-11-5-3-4-6-14(11)18(25)22-21-12(2)9-17(24)20-16-10-13(23(26)27)7-8-15(16)19/h3-10,21H,1-2H3,(H,20,24)(H,22,25)/b12-9+