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

Systemtic Name: ethyl 2-diethoxyphosphoryl-4-methyl-3-(4-methyl-2-oxidanylidene-1-phenyl-pent-3-enyl)sulfanyl-pentanoate Openeye Name: ethyl 2-diethoxyphosphoryl-4-methyl-3-(4-methyl-2-oxo-1-phenyl-pent-3-enyl)sulfanyl-pentanoate CAS Name: 2-diethoxyphosphoryl-4-methyl-3-[(4-methyl-2-oxo-1-phenylpent-3-enyl)thio]pentanoic acid ethyl ester IUPAC Name: ethyl 2-diethoxyphosphoryl-4-methyl-3-(4-methyl-2-oxo-1-phenylpent-3-enyl)sulfanylpentanoate Traditional Name: 2-diethoxyphosphoryl-3-[(2-keto-4-methyl-1-phenyl-pent-3-enyl)thio]-4-methyl-valeric acid ethyl ester Formula: C24H37O6PS MolecularWeight: 484.585741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H37O6PS/c1-8-28-24(26)21(31(27,29-9-2)30-10-3)22(18(6)7)32-23(20(25)16-17(4)5)19-14-12-11-13-15-19/h11-16,18,21-23H,8-10H2,1-7H3