hexyl 7-[3-[5-(4-ethylphenyl)-3-oxidanyl-pentyl]-2-oxidanylidene-1,3-thiazolidin-4-yl]heptanoate

Systemtic Name: hexyl 7-[3-[5-(4-ethylphenyl)-3-oxidanyl-pentyl]-2-oxidanylidene-1,3-thiazolidin-4-yl]heptanoate Openeye Name: hexyl 7-[3-[5-(4-ethylphenyl)-3-hydroxy-pentyl]-2-oxo-thiazolidin-4-yl]heptanoate CAS Name: 7-[3-[5-(4-ethylphenyl)-3-hydroxypentyl]-2-oxo-4-thiazolidinyl]heptanoic acid hexyl ester IUPAC Name: hexyl 7-[3-[5-(4-ethylphenyl)-3-hydroxypentyl]-2-oxo-1,3-thiazolidin-4-yl]heptanoate Traditional Name: 7-[3-[5-(4-ethylphenyl)-3-hydroxy-pentyl]-2-keto-thiazolidin-4-yl]enanthic acid hexyl ester Formula: C29H47NO4S MolecularWeight: 505.75278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCCCCCC1CSC(=O)N1CCC(CCC2=CC=C(C=C2)CC)O

Isomeric SMILES

CCCCCCOC(=O)CCCCCCC1CSC(=O)N1CCC(CCC2=CC=C(C=C2)CC)O

InChI

InChI=1S/C29H47NO4S/c1-3-5-6-11-22-34-28(32)13-10-8-7-9-12-26-23-35-29(33)30(26)21-20-27(31)19-18-25-16-14-24(4-2)15-17-25/h14-17,26-27,31H,3-13,18-23H2,1-2H3