sodium 1-[(2-methyl-1-oxidanyl-butan-2-yl)amino]cyclohexane-1-carboxylate

Systemtic Name: sodium 1-[(2-methyl-1-oxidanyl-butan-2-yl)amino]cyclohexane-1-carboxylate Openeye Name: sodium 1-[[1-(hydroxymethyl)-1-methyl-propyl]amino]cyclohexanecarboxylate CAS Name: sodium 1-[(1-hydroxy-2-methylbutan-2-yl)amino]-1-cyclohexanecarboxylate IUPAC Name: sodium 1-[(1-hydroxy-2-methylbutan-2-yl)amino]cyclohexane-1-carboxylate Traditional Name: sodium 1-[(1-methyl-1-methylol-propyl)amino]cyclohexanecarboxylate Formula: C12H22NNaO3 MolecularWeight: 251.29775

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CO)NC1(CCCCC1)C(=O)[O-].[Na+]

Isomeric SMILES

CCC(C)(CO)NC1(CCCCC1)C(=O)[O-].[Na+]

InChI

InChI=1S/C12H23NO3.Na/c1-3-11(2,9-14)13-12(10(15)16)7-5-4-6-8-12;/h13-14H,3-9H2,1-2H3,(H,15,16);/q;+1/p-1