methyl 1-[(4-chlorophenyl)methyl]-4-diethoxyphosphoryl-5-oxidanylidene-2H-pyrrole-3-carboxylate

Systemtic Name: methyl 1-[(4-chlorophenyl)methyl]-4-diethoxyphosphoryl-5-oxidanylidene-2H-pyrrole-3-carboxylate Openeye Name: methyl 1-[(4-chlorophenyl)methyl]-4-diethoxyphosphoryl-5-oxo-2H-pyrrole-3-carboxylate CAS Name: 1-[(4-chlorophenyl)methyl]-4-diethoxyphosphoryl-5-oxo-2H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-[(4-chlorophenyl)methyl]-4-diethoxyphosphoryl-5-oxo-2H-pyrrole-3-carboxylate Traditional Name: 1-(4-chlorobenzyl)-4-diethoxyphosphoryl-5-keto-3-pyrroline-3-carboxylic acid methyl ester Formula: C17H21ClNO6P MolecularWeight: 401.778501

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(CN(C1=O)CC2=CC=C(C=C2)Cl)C(=O)OC)OCC

Isomeric SMILES

CCOP(=O)(C1=C(CN(C1=O)CC2=CC=C(C=C2)Cl)C(=O)OC)OCC

InChI

InChI=1S/C17H21ClNO6P/c1-4-24-26(22,25-5-2)15-14(17(21)23-3)11-19(16(15)20)10-12-6-8-13(18)9-7-12/h6-9H,4-5,10-11H2,1-3H3