ethyl 4-[[diethoxyphosphoryl-(4-methylsulfanylphenyl)methyl]amino]benzoate

Systemtic Name: ethyl 4-[[diethoxyphosphoryl-(4-methylsulfanylphenyl)methyl]amino]benzoate Openeye Name: ethyl 4-[[diethoxyphosphoryl-(4-methylsulfanylphenyl)methyl]amino]benzoate CAS Name: 4-[[diethoxyphosphoryl-[4-(methylthio)phenyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[diethoxyphosphoryl-(4-methylsulfanylphenyl)methyl]amino]benzoate Traditional Name: 4-[[diethoxyphosphoryl-[4-(methylthio)phenyl]methyl]amino]benzoic acid ethyl ester Formula: C21H28NO5PS MolecularWeight: 437.489481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(C2=CC=C(C=C2)SC)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(C2=CC=C(C=C2)SC)P(=O)(OCC)OCC

InChI

InChI=1S/C21H28NO5PS/c1-5-25-21(23)17-8-12-18(13-9-17)22-20(28(24,26-6-2)27-7-3)16-10-14-19(29-4)15-11-16/h8-15,20,22H,5-7H2,1-4H3