10-ethoxycarbothioylsulfanyl-13-oxidanylidene-13-phenyl-tridecanoic acid

Systemtic Name: 10-ethoxycarbothioylsulfanyl-13-oxidanylidene-13-phenyl-tridecanoic acid Openeye Name: 10-ethoxycarbothioylsulfanyl-13-oxo-13-phenyl-tridecanoic acid CAS Name: 10-[[ethoxy(sulfanylidene)methyl]thio]-13-oxo-13-phenyltridecanoic acid IUPAC Name: 10-ethoxycarbothioylsulfanyl-13-oxo-13-phenyltridecanoic acid Traditional Name: 10-(ethoxycarbothioylthio)-13-keto-13-phenyl-tridecanoic acid Formula: C22H32O4S2 MolecularWeight: 424.61708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC(CCCCCCCCC(=O)O)CCC(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=S)SC(CCCCCCCCC(=O)O)CCC(=O)C1=CC=CC=C1

InChI

InChI=1S/C22H32O4S2/c1-2-26-22(27)28-19(14-10-5-3-4-6-11-15-21(24)25)16-17-20(23)18-12-8-7-9-13-18/h7-9,12-13,19H,2-6,10-11,14-17H2,1H3,(H,24,25)