N-[[(2R)-oxolan-2-yl]methyl]-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[[(2R)-oxolan-2-yl]methyl]-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2S)-2-phenylpropyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[[(2R)-2-oxolanyl]methyl]-1-[(2S)-2-phenylpropyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[[(2R)-oxolan-2-yl]methyl]-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(2S)-2-phenylpropyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCC(CC1)C(=O)NCC2CCCO2)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C[NH+]1CCC(CC1)C(=O)NC[C@H]2CCCO2)C3=CC=CC=C3

InChI

InChI=1S/C20H30N2O2/c1-16(17-6-3-2-4-7-17)15-22-11-9-18(10-12-22)20(23)21-14-19-8-5-13-24-19/h2-4,6-7,16,18-19H,5,8-15H2,1H3,(H,21,23)/p+1/t16-,19-/m1/s1