ethyl (2S)-2-phenyl-2-piperidin-1-ium-1-yl-ethanoate

Systemtic Name: ethyl (2S)-2-phenyl-2-piperidin-1-ium-1-yl-ethanoate Openeye Name: ethyl (2S)-2-phenyl-2-piperidin-1-ium-1-yl-acetate CAS Name: (2S)-2-phenyl-2-(1-piperidin-1-iumyl)acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-phenyl-2-piperidin-1-ium-1-ylacetate Traditional Name: (2S)-2-phenyl-2-piperidin-1-ium-1-yl-acetic acid ethyl ester Formula: C15H22NO2+ MolecularWeight: 248.34068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)[NH+]2CCCCC2

Isomeric SMILES

CCOC(=O)[C@H](C1=CC=CC=C1)[NH+]2CCCCC2

InChI

InChI=1S/C15H21NO2/c1-2-18-15(17)14(13-9-5-3-6-10-13)16-11-7-4-8-12-16/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3/p+1/t14-/m0/s1