ethyl 3-(2-cyclohexyl-2-oxidanyl-1-phenyl-ethyl)sulfanyl-2-diethoxyphosphoryl-4-methyl-pentanoate

Systemtic Name: ethyl 3-(2-cyclohexyl-2-oxidanyl-1-phenyl-ethyl)sulfanyl-2-diethoxyphosphoryl-4-methyl-pentanoate Openeye Name: ethyl 3-(2-cyclohexyl-2-hydroxy-1-phenyl-ethyl)sulfanyl-2-diethoxyphosphoryl-4-methyl-pentanoate CAS Name: 3-[(2-cyclohexyl-2-hydroxy-1-phenylethyl)thio]-2-diethoxyphosphoryl-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 3-(2-cyclohexyl-2-hydroxy-1-phenylethyl)sulfanyl-2-diethoxyphosphoryl-4-methylpentanoate Traditional Name: 3-[(2-cyclohexyl-2-hydroxy-1-phenyl-ethyl)thio]-2-diethoxyphosphoryl-4-methyl-valeric acid ethyl ester Formula: C26H43O6PS MolecularWeight: 514.654781

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(C)C)SC(C1=CC=CC=C1)C(C2CCCCC2)O)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C(C(C(C)C)SC(C1=CC=CC=C1)C(C2CCCCC2)O)P(=O)(OCC)OCC

InChI

InChI=1S/C26H43O6PS/c1-6-30-26(28)23(33(29,31-7-2)32-8-3)24(19(4)5)34-25(21-17-13-10-14-18-21)22(27)20-15-11-9-12-16-20/h10,13-14,17-20,22-25,27H,6-9,11-12,15-16H2,1-5H3