2-(3,3-dimethyl-6-oxidanyl-6-pentadecyl-morpholin-4-ium-2-yl)ethanoic acid

Systemtic Name: 2-(3,3-dimethyl-6-oxidanyl-6-pentadecyl-morpholin-4-ium-2-yl)ethanoic acid Openeye Name: 2-(6-hydroxy-3,3-dimethyl-6-pentadecyl-morpholin-4-ium-2-yl)acetic acid CAS Name: 2-(6-hydroxy-3,3-dimethyl-6-pentadecyl-2-morpholin-4-iumyl)acetic acid IUPAC Name: 2-(6-hydroxy-3,3-dimethyl-6-pentadecylmorpholin-4-ium-2-yl)acetic acid Traditional Name: 2-(6-hydroxy-3,3-dimethyl-6-pentadecyl-morpholin-4-ium-2-yl)acetic acid Formula: C23H46NO4+ MolecularWeight: 400.61564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1(C[NH2+]C(C(O1)CC(=O)O)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCC1(C[NH2+]C(C(O1)CC(=O)O)(C)C)O

InChI

InChI=1S/C23H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(27)19-24-22(2,3)20(28-23)18-21(25)26/h20,24,27H,4-19H2,1-3H3,(H,25,26)/p+1