sodium 2,2-bis(chloranyl)-12-(4-methylsulfanylphenyl)dodecanoate

Systemtic Name: sodium 2,2-bis(chloranyl)-12-(4-methylsulfanylphenyl)dodecanoate Openeye Name: sodium 2,2-dichloro-12-(4-methylsulfanylphenyl)dodecanoate CAS Name: sodium 2,2-dichloro-12-[4-(methylthio)phenyl]dodecanoate IUPAC Name: sodium 2,2-dichloro-12-(4-methylsulfanylphenyl)dodecanoate Traditional Name: sodium 2,2-dichloro-12-[4-(methylthio)phenyl]laurate Formula: C19H27Cl2NaO2S MolecularWeight: 413.37725

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCCCCCCCCCC(C(=O)[O-])(Cl)Cl.[Na+]

Isomeric SMILES

CSC1=CC=C(C=C1)CCCCCCCCCCC(C(=O)[O-])(Cl)Cl.[Na+]

InChI

InChI=1S/C19H28Cl2O2S.Na/c1-24-17-13-11-16(12-14-17)10-8-6-4-2-3-5-7-9-15-19(20,21)18(22)23;/h11-14H,2-10,15H2,1H3,(H,22,23);/q;+1/p-1