2-[(2R,6S)-6-dodecyl-4,4-dimethyl-6-oxidanyl-morpholin-4-ium-2-yl]ethanoic acid

Systemtic Name: 2-[(2R,6S)-6-dodecyl-4,4-dimethyl-6-oxidanyl-morpholin-4-ium-2-yl]ethanoic acid Openeye Name: 2-[(2R,6S)-6-dodecyl-6-hydroxy-4,4-dimethyl-morpholin-4-ium-2-yl]acetic acid CAS Name: 2-[(2R,6S)-6-dodecyl-6-hydroxy-4,4-dimethyl-2-morpholin-4-iumyl]acetic acid IUPAC Name: 2-[(2R,6S)-6-dodecyl-6-hydroxy-4,4-dimethylmorpholin-4-ium-2-yl]acetic acid Traditional Name: 2-[(2R,6S)-6-hydroxy-6-lauryl-4,4-dimethyl-morpholin-4-ium-2-yl]acetic acid Formula: C20H40NO4+ MolecularWeight: 358.5359

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1(C[N+](CC(O1)CC(=O)O)(C)C)O

Isomeric SMILES

CCCCCCCCCCCC[C@]1(C[N+](C[C@H](O1)CC(=O)O)(C)C)O

InChI

InChI=1S/C20H39NO4/c1-4-5-6-7-8-9-10-11-12-13-14-20(24)17-21(2,3)16-18(25-20)15-19(22)23/h18,24H,4-17H2,1-3H3/p+1/t18-,20+/m1/s1