ethyl (5S)-6-methyl-5-oxidanyl-3-oxidanylidene-5-(2-thiophen-3-ylethyl)heptanoate

Systemtic Name: ethyl (5S)-6-methyl-5-oxidanyl-3-oxidanylidene-5-(2-thiophen-3-ylethyl)heptanoate Openeye Name: ethyl (5S)-5-hydroxy-6-methyl-3-oxo-5-[2-(3-thienyl)ethyl]heptanoate CAS Name: (5S)-5-hydroxy-6-methyl-3-oxo-5-[2-(3-thiophenyl)ethyl]heptanoic acid ethyl ester IUPAC Name: ethyl (5S)-5-hydroxy-6-methyl-3-oxo-5-(2-thiophen-3-ylethyl)heptanoate Traditional Name: (5S)-5-hydroxy-3-keto-6-methyl-5-[2-(3-thienyl)ethyl]enanthic acid ethyl ester Formula: C16H24O4S MolecularWeight: 312.42436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CC(CCC1=CSC=C1)(C(C)C)O

Isomeric SMILES

CCOC(=O)CC(=O)C[C@@](CCC1=CSC=C1)(C(C)C)O

InChI

InChI=1S/C16H24O4S/c1-4-20-15(18)9-14(17)10-16(19,12(2)3)7-5-13-6-8-21-11-13/h6,8,11-12,19H,4-5,7,9-10H2,1-3H3/t16-/m0/s1