(3S)-1-(naphthalen-2-ylmethyl)piperidin-1-ium-3-carboxylate

Systemtic Name: (3S)-1-(naphthalen-2-ylmethyl)piperidin-1-ium-3-carboxylate Openeye Name: (3S)-1-(2-naphthylmethyl)piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-(2-naphthalenylmethyl)-3-piperidin-1-iumcarboxylate IUPAC Name: (3S)-1-(naphthalen-2-ylmethyl)piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-(2-naphthylmethyl)piperidin-1-ium-3-carboxylate Formula: C17H19NO2 MolecularWeight: 269.33826

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC3=CC=CC=C3C=C2)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC3=CC=CC=C3C=C2)C(=O)[O-]

InChI

InChI=1S/C17H19NO2/c19-17(20)16-6-3-9-18(12-16)11-13-7-8-14-4-1-2-5-15(14)10-13/h1-2,4-5,7-8,10,16H,3,6,9,11-12H2,(H,19,20)/t16-/m0/s1