ethyl (2R,3R)-3-diethoxyphosphoryl-3,5,5-trimethyl-2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-hexanoate

Systemtic Name: ethyl (2R,3R)-3-diethoxyphosphoryl-3,5,5-trimethyl-2-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-hexanoate Openeye Name: ethyl (2R,3R)-3-diethoxyphosphoryl-3,5,5-trimethyl-4-oxo-2-(p-tolylsulfonylamino)hexanoate CAS Name: (2R,3R)-3-diethoxyphosphoryl-3,5,5-trimethyl-2-[(4-methylphenyl)sulfonylamino]-4-oxohexanoic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-diethoxyphosphoryl-3,5,5-trimethyl-2-[(4-methylphenyl)sulfonylamino]-4-oxohexanoate Traditional Name: (2R,3R)-3-diethoxyphosphoryl-4-keto-3,5,5-trimethyl-2-(tosylamino)hexanoic acid ethyl ester Formula: C22H36NO8PS MolecularWeight: 505.561901

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)(C(=O)C(C)(C)C)P(=O)(OCC)OCC)NS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)[C@H]([C@](C)(C(=O)C(C)(C)C)P(=O)(OCC)OCC)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C22H36NO8PS/c1-9-29-19(24)18(23-33(27,28)17-14-12-16(4)13-15-17)22(8,20(25)21(5,6)7)32(26,30-10-2)31-11-3/h12-15,18,23H,9-11H2,1-8H3/t18-,22-/m1/s1