N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-oxane-4-carboxamide

Systemtic Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-oxane-4-carboxamide Openeye Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-tetrahydropyran-4-carboxamide CAS Name: N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-N-phenethyl-4-oxanecarboxamide IUPAC Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyloxane-4-carboxamide Traditional Name: N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-N-phenethyl-tetrahydropyran-4-carboxamide Formula: C21H33N2O2+ MolecularWeight: 345.49892

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)CN(CCC2=CC=CC=C2)C(=O)C3CCOCC3

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)CN(CCC2=CC=CC=C2)C(=O)C3CCOCC3

InChI

InChI=1S/C21H32N2O2/c1-22-12-5-8-19(16-22)17-23(13-9-18-6-3-2-4-7-18)21(24)20-10-14-25-15-11-20/h2-4,6-7,19-20H,5,8-17H2,1H3/p+1/t19-/m0/s1