ethyl 2-[bis(3-chloranylphenoxy)phosphorylmethyl-(phenylmethylsulfanyl)carbonyl-amino]ethanoate

Systemtic Name: ethyl 2-[bis(3-chloranylphenoxy)phosphorylmethyl-(phenylmethylsulfanyl)carbonyl-amino]ethanoate Openeye Name: ethyl 2-[benzylsulfanylcarbonyl-[bis(3-chlorophenoxy)phosphorylmethyl]amino]acetate CAS Name: 2-[bis(3-chlorophenoxy)phosphorylmethyl-[oxo-(phenylmethylthio)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[benzylsulfanylcarbonyl-[bis(3-chlorophenoxy)phosphorylmethyl]amino]acetate Traditional Name: 2-[(benzylthio)carbonyl-[bis(3-chlorophenoxy)phosphorylmethyl]amino]acetic acid ethyl ester Formula: C25H24Cl2NO6PS MolecularWeight: 568.405921

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CP(=O)(OC1=CC(=CC=C1)Cl)OC2=CC(=CC=C2)Cl)C(=O)SCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN(CP(=O)(OC1=CC(=CC=C1)Cl)OC2=CC(=CC=C2)Cl)C(=O)SCC3=CC=CC=C3

InChI

InChI=1S/C25H24Cl2NO6PS/c1-2-32-24(29)16-28(25(30)36-17-19-8-4-3-5-9-19)18-35(31,33-22-12-6-10-20(26)14-22)34-23-13-7-11-21(27)15-23/h3-15H,2,16-18H2,1H3