2-[(4E)-3-(carboxymethylsulfanyl)-4-decylidene-2-oxidanyl-cyclohexyl]ethanoic acid

Systemtic Name: 2-[(4E)-3-(carboxymethylsulfanyl)-4-decylidene-2-oxidanyl-cyclohexyl]ethanoic acid Openeye Name: 2-[(4E)-3-(carboxymethylsulfanyl)-4-decylidene-2-hydroxy-cyclohexyl]acetic acid CAS Name: 2-[(4E)-3-(carboxymethylthio)-4-decylidene-2-hydroxycyclohexyl]acetic acid IUPAC Name: 2-[(4E)-3-(carboxymethylsulfanyl)-4-decylidene-2-hydroxycyclohexyl]acetic acid Traditional Name: 2-[(4E)-3-(carboxymethylthio)-4-decylidene-2-hydroxy-cyclohexyl]acetic acid Formula: C20H34O5S MolecularWeight: 386.54596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=C1CCC(C(C1SCC(=O)O)O)CC(=O)O

Isomeric SMILES

CCCCCCCCC/C=C/1\CCC(C(C1SCC(=O)O)O)CC(=O)O

InChI

InChI=1S/C20H34O5S/c1-2-3-4-5-6-7-8-9-10-15-11-12-16(13-17(21)22)19(25)20(15)26-14-18(23)24/h10,16,19-20,25H,2-9,11-14H2,1H3,(H,21,22)(H,23,24)/b15-10+