3-[(2-sulfosulfanylethylamino)methyl]pentylcyclohexane

Systemtic Name: 3-[(2-sulfosulfanylethylamino)methyl]pentylcyclohexane Openeye Name: 3-[(2-sulfosulfanylethylamino)methyl]pentylcyclohexane CAS Name: 3-[[2-(sulfothio)ethylamino]methyl]pentylcyclohexane IUPAC Name: 3-[(2-sulfosulfanylethylamino)methyl]pentylcyclohexane Traditional Name: 3-[[2-(sulfothio)ethylamino]methyl]pentylcyclohexane Formula: C14H29NO3S2 MolecularWeight: 323.51496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1CCCCC1)CNCCSS(=O)(=O)O

Isomeric SMILES

CCC(CCC1CCCCC1)CNCCSS(=O)(=O)O

InChI

InChI=1S/C14H29NO3S2/c1-2-13(8-9-14-6-4-3-5-7-14)12-15-10-11-19-20(16,17)18/h13-15H,2-12H2,1H3,(H,16,17,18)