ethyl 3-(2-cyclopentyl-2-oxidanylidene-1-phenyl-ethyl)sulfanyl-2-diethoxyphosphoryl-4-methyl-pentanoate

Systemtic Name: ethyl 3-(2-cyclopentyl-2-oxidanylidene-1-phenyl-ethyl)sulfanyl-2-diethoxyphosphoryl-4-methyl-pentanoate Openeye Name: ethyl 3-(2-cyclopentyl-2-oxo-1-phenyl-ethyl)sulfanyl-2-diethoxyphosphoryl-4-methyl-pentanoate CAS Name: 3-[(2-cyclopentyl-2-oxo-1-phenylethyl)thio]-2-diethoxyphosphoryl-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 3-(2-cyclopentyl-2-oxo-1-phenylethyl)sulfanyl-2-diethoxyphosphoryl-4-methylpentanoate Traditional Name: 3-[(2-cyclopentyl-2-keto-1-phenyl-ethyl)thio]-2-diethoxyphosphoryl-4-methyl-valeric acid ethyl ester Formula: C25H39O6PS MolecularWeight: 498.612321

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(C)C)SC(C1=CC=CC=C1)C(=O)C2CCCC2)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C(C(C(C)C)SC(C1=CC=CC=C1)C(=O)C2CCCC2)P(=O)(OCC)OCC

InChI

InChI=1S/C25H39O6PS/c1-6-29-25(27)22(32(28,30-7-2)31-8-3)23(18(4)5)33-24(20-16-10-9-11-17-20)21(26)19-14-12-13-15-19/h9-11,16-19,22-24H,6-8,12-15H2,1-5H3