ethyl (3E)-2-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-3-(phenylcarbamoylhydrazinylidene)butanoate

Systemtic Name: ethyl (3E)-2-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-3-(phenylcarbamoylhydrazinylidene)butanoate Openeye Name: ethyl (3E)-2-(2-tert-butoxycarbonylhydrazino)-3-(phenylcarbamoylhydrazono)butanoate CAS Name: (3E)-3-[[anilino(oxo)methyl]hydrazinylidene]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]hydrazo]butanoic acid ethyl ester IUPAC Name: ethyl (3E)-2-[2-[(2-methylpropan-2-yl)oxycarbonyl]hydrazinyl]-3-(phenylcarbamoylhydrazinylidene)butanoate Traditional Name: (3E)-2-(N'-tert-butoxycarbonylhydrazino)-3-(phenylcarbamoylhydrazono)butyric acid ethyl ester Formula: C18H27N5O5 MolecularWeight: 393.43748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=NNC(=O)NC1=CC=CC=C1)C)NNC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(/C(=N/NC(=O)NC1=CC=CC=C1)/C)NNC(=O)OC(C)(C)C

InChI

InChI=1S/C18H27N5O5/c1-6-27-15(24)14(21-23-17(26)28-18(3,4)5)12(2)20-22-16(25)19-13-10-8-7-9-11-13/h7-11,14,21H,6H2,1-5H3,(H,23,26)(H2,19,22,25)/b20-12+