20-(3-methoxy-3-oxidanylidene-propyl)sulfanylicos-7-ynoic acid

Systemtic Name: 20-(3-methoxy-3-oxidanylidene-propyl)sulfanylicos-7-ynoic acid Openeye Name: 20-(3-methoxy-3-oxo-propyl)sulfanylicos-7-ynoic acid CAS Name: 20-[(3-methoxy-3-oxopropyl)thio]-7-eicosynoic acid IUPAC Name: 20-(3-methoxy-3-oxopropyl)sulfanylicos-7-ynoic acid Traditional Name: 20-[(3-keto-3-methoxy-propyl)thio]eicos-7-ynoic acid Formula: C24H42O4S MolecularWeight: 426.65288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCCCCCCCCCCCCC#CCCCCCC(=O)O

Isomeric SMILES

COC(=O)CCSCCCCCCCCCCCCC#CCCCCCC(=O)O

InChI

InChI=1S/C24H42O4S/c1-28-24(27)20-22-29-21-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-23(25)26/h2-6,8,10-22H2,1H3,(H,25,26)