sodium 12-[(2,2,5,5-tetramethyl-1-oxidanidyl-pyrrolidin-3-yl)carbonylamino]dodecanoic acid

Systemtic Name: sodium 12-[(2,2,5,5-tetramethyl-1-oxidanidyl-pyrrolidin-3-yl)carbonylamino]dodecanoic acid Openeye Name: sodium 12-[(2,2,5,5-tetramethyl-1-oxido-pyrrolidine-3-carbonyl)amino]dodecanoic acid CAS Name: sodium 12-[[oxo-(2,2,5,5-tetramethyl-1-oxido-3-pyrrolidinyl)methyl]amino]dodecanoic acid IUPAC Name: sodium 12-[(2,2,5,5-tetramethyl-1-oxidopyrrolidine-3-carbonyl)amino]dodecanoic acid Traditional Name: sodium 12-[(2,2,5,5-tetramethyl-1-oxido-pyrrolidine-3-carbonyl)amino]lauric acid Formula: C21H39N2NaO4 MolecularWeight: 406.53513

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(N1[O-])(C)C)C(=O)NCCCCCCCCCCCC(=O)O)C.[Na+]

Isomeric SMILES

CC1(CC(C(N1[O-])(C)C)C(=O)NCCCCCCCCCCCC(=O)O)C.[Na+]

InChI

InChI=1S/C21H39N2O4.Na/c1-20(2)16-17(21(3,4)23(20)27)19(26)22-15-13-11-9-7-5-6-8-10-12-14-18(24)25;/h17H,5-16H2,1-4H3,(H,22,26)(H,24,25);/q-1;+1