[(3S)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(4-benzyloxyphenyl)methyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(4-phenylmethoxyphenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-(4-benzoxybenzyl)piperidin-1-ium-3-yl]methanol Formula: C20H26NO2+ MolecularWeight: 312.42594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CO

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)OCC3=CC=CC=C3)CO

InChI

InChI=1S/C20H25NO2/c22-15-19-7-4-12-21(14-19)13-17-8-10-20(11-9-17)23-16-18-5-2-1-3-6-18/h1-3,5-6,8-11,19,22H,4,7,12-16H2/p+1/t19-/m0/s1