N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]oxane-4-carboxamide

Systemtic Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]oxane-4-carboxamide Openeye Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]tetrahydropyran-4-carboxamide CAS Name: N-[(3S)-1-(3-phenylpropyl)-3-piperidin-1-iumyl]-4-oxanecarboxamide IUPAC Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]oxane-4-carboxamide Traditional Name: N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]tetrahydropyran-4-carboxamide Formula: C20H31N2O2+ MolecularWeight: 331.47234

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCCC2=CC=CC=C2)NC(=O)C3CCOCC3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCCC2=CC=CC=C2)NC(=O)C3CCOCC3

InChI

InChI=1S/C20H30N2O2/c23-20(18-10-14-24-15-11-18)21-19-9-5-13-22(16-19)12-4-8-17-6-2-1-3-7-17/h1-3,6-7,18-19H,4-5,8-16H2,(H,21,23)/p+1/t19-/m0/s1