[(3S)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(2,4,5-trimethoxyphenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(2,4,5-trimethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-(2,4,5-trimethoxybenzyl)piperidin-1-ium-3-yl]methanol Formula: C16H26NO4+ MolecularWeight: 296.38194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C[NH+]2CCCC(C2)CO)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C[NH+]2CCC[C@@H](C2)CO)OC)OC

InChI

InChI=1S/C16H25NO4/c1-19-14-8-16(21-3)15(20-2)7-13(14)10-17-6-4-5-12(9-17)11-18/h7-8,12,18H,4-6,9-11H2,1-3H3/p+1/t12-/m0/s1