(2S)-2-morpholin-4-ium-4-yl-2-(4-propan-2-ylphenyl)ethanoate

Systemtic Name: (2S)-2-morpholin-4-ium-4-yl-2-(4-propan-2-ylphenyl)ethanoate Openeye Name: (2S)-2-(4-isopropylphenyl)-2-morpholin-4-ium-4-yl-acetate CAS Name: (2S)-2-(4-morpholin-4-iumyl)-2-(4-propan-2-ylphenyl)acetate IUPAC Name: (2S)-2-morpholin-4-ium-4-yl-2-(4-propan-2-ylphenyl)acetate Traditional Name: (2S)-2-morpholin-4-ium-4-yl-2-p-cumenyl-acetate Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C(=O)[O-])[NH+]2CCOCC2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@@H](C(=O)[O-])[NH+]2CCOCC2

InChI

InChI=1S/C15H21NO3/c1-11(2)12-3-5-13(6-4-12)14(15(17)18)16-7-9-19-10-8-16/h3-6,11,14H,7-10H2,1-2H3,(H,17,18)/t14-/m0/s1