(3R,4S)-3-butyl-1-methyl-4-phenyl-piperidin-1-ium-4-ol

Systemtic Name: (3R,4S)-3-butyl-1-methyl-4-phenyl-piperidin-1-ium-4-ol Openeye Name: (3R,4S)-3-butyl-1-methyl-4-phenyl-piperidin-1-ium-4-ol CAS Name: (3R,4S)-3-butyl-1-methyl-4-phenyl-4-piperidin-1-iumol IUPAC Name: (3R,4S)-3-butyl-1-methyl-4-phenylpiperidin-1-ium-4-ol Traditional Name: (3R,4S)-3-butyl-1-methyl-4-phenyl-piperidin-1-ium-4-ol Formula: C16H26NO+ MolecularWeight: 248.38374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C[NH+](CCC1(C2=CC=CC=C2)O)C

Isomeric SMILES

CCCC[C@@H]1C[NH+](CC[C@]1(C2=CC=CC=C2)O)C

InChI

InChI=1S/C16H25NO/c1-3-4-8-15-13-17(2)12-11-16(15,18)14-9-6-5-7-10-14/h5-7,9-10,15,18H,3-4,8,11-13H2,1-2H3/p+1/t15-,16-/m1/s1