N,N-diethyl-2-[(3R,4R)-4-(4-methoxyphenyl)-3-oxidanyl-piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[(3R,4R)-4-(4-methoxyphenyl)-3-oxidanyl-piperidin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[(3R,4R)-3-hydroxy-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[(3R,4R)-3-hydroxy-4-(4-methoxyphenyl)-1-piperidin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[(3R,4R)-3-hydroxy-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[(3R,4R)-3-hydroxy-4-(4-methoxyphenyl)piperidin-1-ium-1-yl]acetamide Formula: C18H29N2O3+ MolecularWeight: 321.43446

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCC(C(C1)O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CC[C@@H]([C@H](C1)O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H28N2O3/c1-4-20(5-2)18(22)13-19-11-10-16(17(21)12-19)14-6-8-15(23-3)9-7-14/h6-9,16-17,21H,4-5,10-13H2,1-3H3/p+1/t16-,17+/m1/s1