tert-butyl 5-[bis(2-cyanoethoxy)phosphanyloxymethyl]-2,2-dimethyl-5-(2-methylsulfinylethyl)-6-pentadecyl-1,3-oxazinane-3-carboxylate

Systemtic Name: tert-butyl 5-[bis(2-cyanoethoxy)phosphanyloxymethyl]-2,2-dimethyl-5-(2-methylsulfinylethyl)-6-pentadecyl-1,3-oxazinane-3-carboxylate Openeye Name: tert-butyl 5-[bis(2-cyanoethoxy)phosphanyloxymethyl]-2,2-dimethyl-5-(2-methylsulfinylethyl)-6-pentadecyl-1,3-oxazinane-3-carboxylate CAS Name: 5-[bis(2-cyanoethoxy)phosphinooxymethyl]-2,2-dimethyl-5-(2-methylsulfinylethyl)-6-pentadecyl-1,3-oxazinane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[bis(2-cyanoethoxy)phosphanyloxymethyl]-2,2-dimethyl-5-(2-methylsulfinylethyl)-6-pentadecyl-1,3-oxazinane-3-carboxylate Traditional Name: 5-[bis(2-cyanoethoxy)phosphinooxymethyl]-2,2-dimethyl-5-(2-methylsulfinylethyl)-6-pentadecyl-1,3-oxazinane-3-carboxylic acid tert-butyl ester Formula: C36H66N3O7PS MolecularWeight: 715.963901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1C(CN(C(O1)(C)C)C(=O)OC(C)(C)C)(CCS(=O)C)COP(OCCC#N)OCCC#N

Isomeric SMILES

CCCCCCCCCCCCCCCC1C(CN(C(O1)(C)C)C(=O)OC(C)(C)C)(CCS(=O)C)COP(OCCC#N)OCCC#N

InChI

InChI=1S/C36H66N3O7PS/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-23-32-36(24-29-48(7)41,31-44-47(42-27-21-25-37)43-28-22-26-38)30-39(35(5,6)45-32)33(40)46-34(2,3)4/h32H,8-24,27-31H2,1-7H3