7-(2-sulfanylethylamino)heptyl hydrogen sulfate

Systemtic Name: 7-(2-sulfanylethylamino)heptyl hydrogen sulfate Openeye Name: 7-(2-sulfanylethylamino)heptyl hydrogen sulfate CAS Name: sulfuric acid 7-(2-mercaptoethylamino)heptyl ester IUPAC Name: 7-(2-sulfanylethylamino)heptyl hydrogen sulfate Traditional Name: sulfuric acid 7-(2-mercaptoethylamino)heptyl ester Formula: C9H21NO4S2 MolecularWeight: 271.39734

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCNCCS)CCCOS(=O)(=O)O

Isomeric SMILES

C(CCCNCCS)CCCOS(=O)(=O)O

InChI

InChI=1S/C9H21NO4S2/c11-16(12,13)14-8-5-3-1-2-4-6-10-7-9-15/h10,15H,1-9H2,(H,11,12,13)