4-[(E)-octadec-6-enoyl]-5-oxidanyl-thiophen-3-one

Systemtic Name: 4-[(E)-octadec-6-enoyl]-5-oxidanyl-thiophen-3-one Openeye Name: 5-hydroxy-4-[(E)-octadec-6-enoyl]thiophen-3-one CAS Name: 5-hydroxy-4-[(E)-1-oxooctadec-6-enyl]-3-thiophenone IUPAC Name: 5-hydroxy-4-[(E)-octadec-6-enoyl]thiophen-3-one Traditional Name: 5-hydroxy-4-[(E)-octadec-6-enoyl]thiophen-3-one Formula: C22H36O3S MolecularWeight: 380.58444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC=CCCCCC(=O)C1=C(SCC1=O)O

Isomeric SMILES

CCCCCCCCCCC/C=C/CCCCC(=O)C1=C(SCC1=O)O

InChI

InChI=1S/C22H36O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(23)21-20(24)18-26-22(21)25/h12-13,25H,2-11,14-18H2,1H3/b13-12+