(E)-3-[2-(4-tert-butylphenyl)carbonylhydrazinyl]-N-(4-methoxy-2-nitro-phenyl)but-2-enamide

Systemtic Name: (E)-3-[2-(4-tert-butylphenyl)carbonylhydrazinyl]-N-(4-methoxy-2-nitro-phenyl)but-2-enamide Openeye Name: (E)-3-[2-(4-tert-butylbenzoyl)hydrazino]-N-(4-methoxy-2-nitro-phenyl)but-2-enamide CAS Name: (E)-3-[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-N-(4-methoxy-2-nitrophenyl)-2-butenamide IUPAC Name: (E)-3-[2-(4-tert-butylbenzoyl)hydrazinyl]-N-(4-methoxy-2-nitrophenyl)but-2-enamide Traditional Name: (E)-3-[N'-(4-tert-butylbenzoyl)hydrazino]-N-(4-methoxy-2-nitro-phenyl)but-2-enamide Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5/c1-14(24-25-21(28)15-6-8-16(9-7-15)22(2,3)4)12-20(27)23-18-11-10-17(31-5)13-19(18)26(29)30/h6-13,24H,1-5H3,(H,23,27)(H,25,28)/b14-12+