dimethyl 2-[(E)-4-diethoxyphosphoryloxybut-2-enyl]-2-(5-oxidanylidenepentyl)propanedioate

Systemtic Name: dimethyl 2-[(E)-4-diethoxyphosphoryloxybut-2-enyl]-2-(5-oxidanylidenepentyl)propanedioate Openeye Name: dimethyl 2-[(E)-4-diethoxyphosphoryloxybut-2-enyl]-2-(5-oxopentyl)propanedioate CAS Name: 2-[(E)-4-diethoxyphosphoryloxybut-2-enyl]-2-(5-oxopentyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-4-diethoxyphosphoryloxybut-2-enyl]-2-(5-oxopentyl)propanedioate Traditional Name: 2-[(E)-4-diethoxyphosphoryloxybut-2-enyl]-2-(5-ketopentyl)malonic acid dimethyl ester Formula: C18H31O9P MolecularWeight: 422.407101

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC)OCC=CCC(CCCCC=O)(C(=O)OC)C(=O)OC

Isomeric SMILES

CCOP(=O)(OCC)OC/C=C/CC(CCCCC=O)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H31O9P/c1-5-25-28(22,26-6-2)27-15-11-9-13-18(16(20)23-3,17(21)24-4)12-8-7-10-14-19/h9,11,14H,5-8,10,12-13,15H2,1-4H3/b11-9+