2-(2-methoxyphenoxy)-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]ethanamide

Systemtic Name: 2-(2-methoxyphenoxy)-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]ethanamide Openeye Name: N-[[2-[(3S)-3-hydroxy-1-piperidyl]pyridin-1-ium-3-yl]methyl]-2-(2-methoxyphenoxy)acetamide CAS Name: N-[[2-[(3S)-3-hydroxy-1-piperidinyl]-3-pyridin-1-iumyl]methyl]-2-(2-methoxyphenoxy)acetamide IUPAC Name: N-[[2-[(3S)-3-hydroxypiperidin-1-yl]pyridin-1-ium-3-yl]methyl]-2-(2-methoxyphenoxy)acetamide Traditional Name: N-[[2-[(3S)-3-hydroxypiperidino]pyridin-1-ium-3-yl]methyl]-2-(2-methoxyphenoxy)acetamide Formula: C20H26N3O4+ MolecularWeight: 372.43814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(=O)NCC2=C([NH+]=CC=C2)N3CCCC(C3)O

Isomeric SMILES

COC1=CC=CC=C1OCC(=O)NCC2=C([NH+]=CC=C2)N3CCC[C@@H](C3)O

InChI

InChI=1S/C20H25N3O4/c1-26-17-8-2-3-9-18(17)27-14-19(25)22-12-15-6-4-10-21-20(15)23-11-5-7-16(24)13-23/h2-4,6,8-10,16,24H,5,7,11-14H2,1H3,(H,22,25)/p+1/t16-/m0/s1