3-(1-cyanohexylamino)propane-1-sulfonic acid

Systemtic Name: 3-(1-cyanohexylamino)propane-1-sulfonic acid Openeye Name: 3-(1-cyanohexylamino)propane-1-sulfonic acid CAS Name: 3-(1-cyanohexylamino)-1-propanesulfonic acid IUPAC Name: 3-(1-cyanohexylamino)propane-1-sulfonic acid Traditional Name: 3-(1-cyanohexylamino)propane-1-sulfonic acid Formula: C10H20N2O3S MolecularWeight: 248.3424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C#N)NCCCS(=O)(=O)O

Isomeric SMILES

CCCCCC(C#N)NCCCS(=O)(=O)O

InChI

InChI=1S/C10H20N2O3S/c1-2-3-4-6-10(9-11)12-7-5-8-16(13,14)15/h10,12H,2-8H2,1H3,(H,13,14,15)