[4-(3-methylbutoxy)phenyl]methylsulfanyl sulfate

Systemtic Name: [4-(3-methylbutoxy)phenyl]methylsulfanyl sulfate Openeye Name: (4-isopentyloxyphenyl)methylsulfanyl sulfate CAS Name: [[4-(3-methylbutoxy)phenyl]methylthio] sulfate IUPAC Name: [4-(3-methylbutoxy)phenyl]methylsulfanyl sulfate Traditional Name: [(4-isoamoxybenzyl)thio] sulfate Formula: C12H17O5S2- MolecularWeight: 305.39038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)CSOS(=O)(=O)[O-]

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)CSOS(=O)(=O)[O-]

InChI

InChI=1S/C12H18O5S2/c1-10(2)7-8-16-12-5-3-11(4-6-12)9-18-17-19(13,14)15/h3-6,10H,7-9H2,1-2H3,(H,13,14,15)/p-1