[(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] 2-(4-methoxyphenyl)ethanoate

Systemtic Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] 2-(4-methoxyphenyl)ethanoate Openeye Name: [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] 2-(4-methoxyphenyl)acetate CAS Name: 2-(4-methoxyphenyl)acetic acid [(2R)-1-(1-piperidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] 2-(4-methoxyphenyl)acetate Traditional Name: 2-(4-methoxyphenyl)acetic acid [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] ester Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)OC(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H](C[NH+]1CCCCC1)OC(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H25NO3/c1-14(13-18-10-4-3-5-11-18)21-17(19)12-15-6-8-16(20-2)9-7-15/h6-9,14H,3-5,10-13H2,1-2H3/p+1/t14-/m1/s1