3-azanyl-2-oxidanyl-5-sulfo-cyclohexane-1-carboxylic acid

Systemtic Name: 3-azanyl-2-oxidanyl-5-sulfo-cyclohexane-1-carboxylic acid Openeye Name: 3-amino-2-hydroxy-5-sulfo-cyclohexanecarboxylic acid CAS Name: 3-amino-2-hydroxy-5-sulfo-1-cyclohexanecarboxylic acid IUPAC Name: 3-amino-2-hydroxy-5-sulfocyclohexane-1-carboxylic acid Traditional Name: 3-amino-2-hydroxy-5-sulfo-cyclohexanecarboxylic acid Formula: C7H13NO6S MolecularWeight: 239.24622

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(C(C1C(=O)O)O)N)S(=O)(=O)O

Isomeric SMILES

C1C(CC(C(C1C(=O)O)O)N)S(=O)(=O)O

InChI

InChI=1S/C7H13NO6S/c8-5-2-3(15(12,13)14)1-4(6(5)9)7(10)11/h3-6,9H,1-2,8H2,(H,10,11)(H,12,13,14)