[(3S)-1-[(4-chlorophenyl)methyl]-3-(2-phenoxyethyl)piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(4-chlorophenyl)methyl]-3-(2-phenoxyethyl)piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(4-chlorophenyl)methyl]-3-(2-phenoxyethyl)piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(4-chlorophenyl)methyl]-3-(2-phenoxyethyl)-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(4-chlorophenyl)methyl]-3-(2-phenoxyethyl)piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-(4-chlorobenzyl)-3-(2-phenoxyethyl)piperidin-1-ium-3-yl]methanol Formula: C21H27ClNO2+ MolecularWeight: 360.89758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)Cl)(CCOC3=CC=CC=C3)CO

Isomeric SMILES

C1C[C@@](C[NH+](C1)CC2=CC=C(C=C2)Cl)(CCOC3=CC=CC=C3)CO

InChI

InChI=1S/C21H26ClNO2/c22-19-9-7-18(8-10-19)15-23-13-4-11-21(16-23,17-24)12-14-25-20-5-2-1-3-6-20/h1-3,5-10,24H,4,11-17H2/p+1/t21-/m0/s1