6-(5-decyl-3-methyl-thiophen-2-yl)-6-oxidanyl-hexanoic acid

Systemtic Name: 6-(5-decyl-3-methyl-thiophen-2-yl)-6-oxidanyl-hexanoic acid Openeye Name: 6-(5-decyl-3-methyl-2-thienyl)-6-hydroxy-hexanoic acid CAS Name: 6-(5-decyl-3-methyl-2-thiophenyl)-6-hydroxyhexanoic acid IUPAC Name: 6-(5-decyl-3-methylthiophen-2-yl)-6-hydroxyhexanoic acid Traditional Name: 6-(5-decyl-3-methyl-2-thienyl)-6-hydroxy-hexanoic acid Formula: C21H36O3S MolecularWeight: 368.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC(=C(S1)C(CCCCC(=O)O)O)C

Isomeric SMILES

CCCCCCCCCCC1=CC(=C(S1)C(CCCCC(=O)O)O)C

InChI

InChI=1S/C21H36O3S/c1-3-4-5-6-7-8-9-10-13-18-16-17(2)21(25-18)19(22)14-11-12-15-20(23)24/h16,19,22H,3-15H2,1-2H3,(H,23,24)