(phenylmethyl) (3E)-3-(aminocarbonylhydrazinylidene)-2-diethoxyphosphoryl-butanoate

Systemtic Name: (phenylmethyl) (3E)-3-(aminocarbonylhydrazinylidene)-2-diethoxyphosphoryl-butanoate Openeye Name: benzyl (3E)-3-(carbamoylhydrazono)-2-diethoxyphosphoryl-butanoate CAS Name: (3E)-3-(carbamoylhydrazinylidene)-2-diethoxyphosphorylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3E)-3-(carbamoylhydrazinylidene)-2-diethoxyphosphorylbutanoate Traditional Name: (3E)-2-diethoxyphosphoryl-3-semicarbazono-butyric acid benzyl ester Formula: C16H24N3O6P MolecularWeight: 385.352021

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C(=NNC(=O)N)C)C(=O)OCC1=CC=CC=C1)OCC

Isomeric SMILES

CCOP(=O)(C(/C(=N/NC(=O)N)/C)C(=O)OCC1=CC=CC=C1)OCC

InChI

InChI=1S/C16H24N3O6P/c1-4-24-26(22,25-5-2)14(12(3)18-19-16(17)21)15(20)23-11-13-9-7-6-8-10-13/h6-10,14H,4-5,11H2,1-3H3,(H3,17,19,21)/b18-12+