sodium [4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)cyclohexyl]methanesulfonate

Systemtic Name: sodium [4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)cyclohexyl]methanesulfonate Openeye Name: sodium [4-(2-amino-3-hydroxy-3-oxo-propyl)cyclohexyl]methanesulfonate CAS Name: sodium [4-(2-amino-3-hydroxy-3-oxopropyl)cyclohexyl]methanesulfonate IUPAC Name: sodium [4-(2-amino-3-hydroxy-3-oxopropyl)cyclohexyl]methanesulfonate Traditional Name: sodium [4-(2-amino-3-hydroxy-3-keto-propyl)cyclohexyl]methanesulfonate Formula: C10H18NNaO5S MolecularWeight: 287.30839

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(C(=O)O)N)CS(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1CC(CCC1CC(C(=O)O)N)CS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H19NO5S.Na/c11-9(10(12)13)5-7-1-3-8(4-2-7)6-17(14,15)16;/h7-9H,1-6,11H2,(H,12,13)(H,14,15,16);/q;+1/p-1