(3S)-3-phenyl-1-piperidin-1-ium-1-yl-hexan-3-ol

Systemtic Name: (3S)-3-phenyl-1-piperidin-1-ium-1-yl-hexan-3-ol Openeye Name: (3S)-3-phenyl-1-piperidin-1-ium-1-yl-hexan-3-ol CAS Name: (3S)-3-phenyl-1-(1-piperidin-1-iumyl)-3-hexanol IUPAC Name: (3S)-3-phenyl-1-piperidin-1-ium-1-ylhexan-3-ol Traditional Name: (3S)-3-phenyl-1-piperidin-1-ium-1-yl-hexan-3-ol Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC[NH+]1CCCCC1)(C2=CC=CC=C2)O

Isomeric SMILES

CCC[C@](CC[NH+]1CCCCC1)(C2=CC=CC=C2)O

InChI

InChI=1S/C17H27NO/c1-2-11-17(19,16-9-5-3-6-10-16)12-15-18-13-7-4-8-14-18/h3,5-6,9-10,19H,2,4,7-8,11-15H2,1H3/p+1/t17-/m0/s1