tert-butyl (2R)-3-(3-chloranyl-4-methoxy-phenyl)-2-(2-diethoxyphosphorylethanoylamino)propanoate

Systemtic Name: tert-butyl (2R)-3-(3-chloranyl-4-methoxy-phenyl)-2-(2-diethoxyphosphorylethanoylamino)propanoate Openeye Name: tert-butyl (2R)-3-(3-chloro-4-methoxy-phenyl)-2-[(2-diethoxyphosphorylacetyl)amino]propanoate CAS Name: (2R)-3-(3-chloro-4-methoxyphenyl)-2-[(2-diethoxyphosphoryl-1-oxoethyl)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-3-(3-chloro-4-methoxyphenyl)-2-[(2-diethoxyphosphorylacetyl)amino]propanoate Traditional Name: (2R)-3-(3-chloro-4-methoxy-phenyl)-2-[(2-diethoxyphosphorylacetyl)amino]propionic acid tert-butyl ester Formula: C20H31ClNO7P MolecularWeight: 463.889401

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC(=O)NC(CC1=CC(=C(C=C1)OC)Cl)C(=O)OC(C)(C)C)OCC

Isomeric SMILES

CCOP(=O)(CC(=O)N[C@H](CC1=CC(=C(C=C1)OC)Cl)C(=O)OC(C)(C)C)OCC

InChI

InChI=1S/C20H31ClNO7P/c1-7-27-30(25,28-8-2)13-18(23)22-16(19(24)29-20(3,4)5)12-14-9-10-17(26-6)15(21)11-14/h9-11,16H,7-8,12-13H2,1-6H3,(H,22,23)/t16-/m1/s1