(E)-3-[2-(4-methyl-3-nitro-phenyl)carbonylhydrazinyl]-N-(2-morpholin-4-ylethyl)but-2-enamide

Systemtic Name: (E)-3-[2-(4-methyl-3-nitro-phenyl)carbonylhydrazinyl]-N-(2-morpholin-4-ylethyl)but-2-enamide Openeye Name: (E)-3-[2-(4-methyl-3-nitro-benzoyl)hydrazino]-N-(2-morpholinoethyl)but-2-enamide CAS Name: (E)-3-[[(4-methyl-3-nitrophenyl)-oxomethyl]hydrazo]-N-[2-(4-morpholinyl)ethyl]-2-butenamide IUPAC Name: (E)-3-[2-(4-methyl-3-nitrobenzoyl)hydrazinyl]-N-(2-morpholin-4-ylethyl)but-2-enamide Traditional Name: (E)-3-[N'-(4-methyl-3-nitro-benzoyl)hydrazino]-N-(2-morpholinoethyl)but-2-enamide Formula: C18H25N5O5 MolecularWeight: 391.4216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=CC(=O)NCCN2CCOCC2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NN/C(=C/C(=O)NCCN2CCOCC2)/C)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O5/c1-13-3-4-15(12-16(13)23(26)27)18(25)21-20-14(2)11-17(24)19-5-6-22-7-9-28-10-8-22/h3-4,11-12,20H,5-10H2,1-2H3,(H,19,24)(H,21,25)/b14-11+