2-azanyl-2-methylsulfonyl-3-oxidanyl-1-phenyl-hexane-3-sulfonic acid

Systemtic Name: 2-azanyl-2-methylsulfonyl-3-oxidanyl-1-phenyl-hexane-3-sulfonic acid Openeye Name: 2-amino-3-hydroxy-2-methylsulfonyl-1-phenyl-hexane-3-sulfonic acid CAS Name: 2-amino-3-hydroxy-2-methylsulfonyl-1-phenyl-3-hexanesulfonic acid IUPAC Name: 2-amino-3-hydroxy-2-methylsulfonyl-1-phenylhexane-3-sulfonic acid Traditional Name: 2-amino-3-hydroxy-2-mesyl-1-phenyl-hexane-3-sulfonic acid Formula: C13H21NO6S2 MolecularWeight: 351.43894

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC1=CC=CC=C1)(N)S(=O)(=O)C)(O)S(=O)(=O)O

Isomeric SMILES

CCCC(C(CC1=CC=CC=C1)(N)S(=O)(=O)C)(O)S(=O)(=O)O

InChI

InChI=1S/C13H21NO6S2/c1-3-9-13(15,22(18,19)20)12(14,21(2,16)17)10-11-7-5-4-6-8-11/h4-8,15H,3,9-10,14H2,1-2H3,(H,18,19,20)